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Nitrobenzoic acids and derivatives

Organic compounds that consist of benzoic acid with a nitro group substitution; a nitro group has a nitrogen atom bonded to two oxygen groups in a single and a double bond. Includes compounds that are directly derived from nitrobenzoic acid.
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Quantità 
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Percent Purity 
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Forma fisica 
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Punti di ebollizione 
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Molecular Weight (g/mol)

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Quantità

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Percent Purity

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Forma fisica

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Punti di ebollizione

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Grado

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1

Methyl 3-nitrobenzoate, 98%

CAS: 618-95-1 Formula molecolare: C8H7NO4 Molecular Weight (g/mol): 181.15 Numero MDL: MFCD00007250 InChI Key: AXLYJLKKPUICKV-UHFFFAOYSA-N Sinonimo: 3-nitrobenzoic acid methyl ester,methyl m-nitrobenzoate,methyl3-nitrobenzoate,benzoic acid, 3-nitro-, methyl ester,m-nitrobenzoic acid, methyl ester,benzoic acid, m-nitro-, methyl ester,3-nitro-benzoic acid methyl ester,3-nitro-benzoicacimethylester,acmc-209mxc,methyl 3-nitro-benzoate PubChem CID: 69260 IUPAC Name: methyl 3-nitrobenzoate SMILES: COC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

Sinonimo 3-nitrobenzoic acid methyl ester,methyl m-nitrobenzoate,methyl3-nitrobenzoate,benzoic acid, 3-nitro-, methyl ester,m-nitrobenzoic acid, methyl ester,benzoic acid, m-nitro-, methyl ester,3-nitro-benzoic acid methyl ester,3-nitro-benzoicacimethylester,acmc-209mxc,methyl 3-nitro-benzoate
Numero MDL MFCD00007250
PubChem CID 69260
Formula molecolare C8H7NO4
CAS 618-95-1
Molecular Weight (g/mol) 181.15
SMILES COC(=O)C1=CC(=CC=C1)[N+](=O)[O-]
IUPAC Name methyl 3-nitrobenzoate
InChI Key AXLYJLKKPUICKV-UHFFFAOYSA-N
2
Promozioni disponibili

5,5'-Dithiobis(2-nitrobenzoic acid), 99%

CAS: 69-78-3 Formula molecolare: C14H8N2O8S2 Molecular Weight (g/mol): 396.34 Numero MDL: MFCD00007140 InChI Key: KIUMMUBSPKGMOY-UHFFFAOYSA-N Sinonimo: dtnb,5,5'-dithiobis 2-nitrobenzoic acid,ellman's reagent,3-carboxy-4-nitrophenyl disulfide,dithionitrobenzoic acid,dithiobisnitrobenzoic acid,5,5'-disulfanediylbis 2-nitrobenzoic acid,benzoic acid, 3,3'-dithiobis 6-nitro,3,3'-dithiobis 6-nitrobenzoic acid,5,5'-dithio-bis 2-nitrobenzoic acid PubChem CID: 6254 ChEBI: CHEBI:86228 IUPAC Name: 5-[(3-carboxy-4-nitrophenyl)disulfanyl]-2-nitrobenzoic acid SMILES: OC(=O)C1=CC(SSC2=CC=C(C(=C2)C(O)=O)[N+]([O-])=O)=CC=C1[N+]([O-])=O

EDGE
Sinonimo dtnb,5,5'-dithiobis 2-nitrobenzoic acid,ellman's reagent,3-carboxy-4-nitrophenyl disulfide,dithionitrobenzoic acid,dithiobisnitrobenzoic acid,5,5'-disulfanediylbis 2-nitrobenzoic acid,benzoic acid, 3,3'-dithiobis 6-nitro,3,3'-dithiobis 6-nitrobenzoic acid,5,5'-dithio-bis 2-nitrobenzoic acid
Numero MDL MFCD00007140
PubChem CID 6254
Formula molecolare C14H8N2O8S2
CAS 69-78-3
Molecular Weight (g/mol) 396.34
ChEBI CHEBI:86228
SMILES OC(=O)C1=CC(SSC2=CC=C(C(=C2)C(O)=O)[N+]([O-])=O)=CC=C1[N+]([O-])=O
IUPAC Name 5-[(3-carboxy-4-nitrophenyl)disulfanyl]-2-nitrobenzoic acid
InChI Key KIUMMUBSPKGMOY-UHFFFAOYSA-N
3

5,5'-Dithiobis-(2-nitrobenzoic acid), 99%

CAS: 69-78-3 Formula molecolare: C14H8N2O8S2 Molecular Weight (g/mol): 396.34 Numero MDL: MFCD00007140 InChI Key: KIUMMUBSPKGMOY-UHFFFAOYSA-N Sinonimo: dtnb,5,5'-dithiobis 2-nitrobenzoic acid,ellman's reagent,3-carboxy-4-nitrophenyl disulfide,dithionitrobenzoic acid,dithiobisnitrobenzoic acid,5,5'-disulfanediylbis 2-nitrobenzoic acid,benzoic acid, 3,3'-dithiobis 6-nitro,3,3'-dithiobis 6-nitrobenzoic acid,5,5'-dithio-bis 2-nitrobenzoic acid PubChem CID: 6254 ChEBI: CHEBI:86228 IUPAC Name: 5-[(3-carboxy-4-nitrophenyl)disulfanyl]-2-nitrobenzoic acid SMILES: OC(=O)C1=CC(SSC2=CC=C(C(=C2)C(O)=O)[N+]([O-])=O)=CC=C1[N+]([O-])=O

EDGE
Sinonimo dtnb,5,5'-dithiobis 2-nitrobenzoic acid,ellman's reagent,3-carboxy-4-nitrophenyl disulfide,dithionitrobenzoic acid,dithiobisnitrobenzoic acid,5,5'-disulfanediylbis 2-nitrobenzoic acid,benzoic acid, 3,3'-dithiobis 6-nitro,3,3'-dithiobis 6-nitrobenzoic acid,5,5'-dithio-bis 2-nitrobenzoic acid
Numero MDL MFCD00007140
PubChem CID 6254
Formula molecolare C14H8N2O8S2
CAS 69-78-3
Molecular Weight (g/mol) 396.34
ChEBI CHEBI:86228
SMILES OC(=O)C1=CC(SSC2=CC=C(C(=C2)C(O)=O)[N+]([O-])=O)=CC=C1[N+]([O-])=O
IUPAC Name 5-[(3-carboxy-4-nitrophenyl)disulfanyl]-2-nitrobenzoic acid
InChI Key KIUMMUBSPKGMOY-UHFFFAOYSA-N
4

2-Nitrobenzoic acid, 95%

CAS: 552-16-9 Formula molecolare: C7H5NO4 Molecular Weight (g/mol): 167.12 Numero MDL: MFCD00007137 InChI Key: SLAMLWHELXOEJZ-UHFFFAOYSA-N Sinonimo: 2-nitrobenzoic acid,o-nitrobenzoic acid,benzoic acid, 2-nitro,2-nitrobenzoicacid,o-carboxynitrobenzene,benzoic acid, o-nitro,nitrobenzoic acid,2-nitro-benzoic acid,ccris 2334,2-nitro benzoic acid PubChem CID: 11087 ChEBI: CHEBI:25620 SMILES: C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]

Sinonimo 2-nitrobenzoic acid,o-nitrobenzoic acid,benzoic acid, 2-nitro,2-nitrobenzoicacid,o-carboxynitrobenzene,benzoic acid, o-nitro,nitrobenzoic acid,2-nitro-benzoic acid,ccris 2334,2-nitro benzoic acid
Numero MDL MFCD00007137
PubChem CID 11087
Formula molecolare C7H5NO4
CAS 552-16-9
Molecular Weight (g/mol) 167.12
ChEBI CHEBI:25620
SMILES C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]
InChI Key SLAMLWHELXOEJZ-UHFFFAOYSA-N
5

4-Nitrobenzoic acid, 99%

CAS: 62-23-7 Formula molecolare: C7H5NO4 Molecular Weight (g/mol): 167.12 Numero MDL: MFCD00007352 InChI Key: OTLNPYWUJOZPPA-UHFFFAOYSA-N Sinonimo: 4-nitrobenzoic acid,p-nitrobenzoic acid,benzoic acid, 4-nitro,nitrodracylic acid,4-nitrodracylic acid,1-carboxy-4-nitrobenzene,benzoic acid, p-nitro,p-nitrobenzoicacid,p-nitrobenzenecarboxylic acid,kyselina p-nitrobenzoova PubChem CID: 6108 ChEBI: CHEBI:262350 SMILES: C1=CC(=CC=C1C(=O)O)[N+](=O)[O-]

Sinonimo 4-nitrobenzoic acid,p-nitrobenzoic acid,benzoic acid, 4-nitro,nitrodracylic acid,4-nitrodracylic acid,1-carboxy-4-nitrobenzene,benzoic acid, p-nitro,p-nitrobenzoicacid,p-nitrobenzenecarboxylic acid,kyselina p-nitrobenzoova
Numero MDL MFCD00007352
PubChem CID 6108
Formula molecolare C7H5NO4
CAS 62-23-7
Molecular Weight (g/mol) 167.12
ChEBI CHEBI:262350
SMILES C1=CC(=CC=C1C(=O)O)[N+](=O)[O-]
InChI Key OTLNPYWUJOZPPA-UHFFFAOYSA-N
6

2-Nitrobenzoic acid, 95%

CAS: 552-16-9 Formula molecolare: C7H5NO4 Molecular Weight (g/mol): 167.12 Numero MDL: MFCD00007137 InChI Key: SLAMLWHELXOEJZ-UHFFFAOYSA-N Sinonimo: 2-nitrobenzoic acid,o-nitrobenzoic acid,benzoic acid, 2-nitro,2-nitrobenzoicacid,o-carboxynitrobenzene,benzoic acid, o-nitro,nitrobenzoic acid,2-nitro-benzoic acid,ccris 2334,2-nitro benzoic acid PubChem CID: 11087 ChEBI: CHEBI:25620 SMILES: C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]

Sinonimo 2-nitrobenzoic acid,o-nitrobenzoic acid,benzoic acid, 2-nitro,2-nitrobenzoicacid,o-carboxynitrobenzene,benzoic acid, o-nitro,nitrobenzoic acid,2-nitro-benzoic acid,ccris 2334,2-nitro benzoic acid
Numero MDL MFCD00007137
PubChem CID 11087
Formula molecolare C7H5NO4
CAS 552-16-9
Molecular Weight (g/mol) 167.12
ChEBI CHEBI:25620
SMILES C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]
InChI Key SLAMLWHELXOEJZ-UHFFFAOYSA-N
7

4-Methyl-3-nitrobenzoic acid, 99%

CAS: 96-98-0 Formula molecolare: C8H7NO4 Molecular Weight (g/mol): 181.15 Numero MDL: MFCD00007174 InChI Key: BBEWSMNRCUXQRF-UHFFFAOYSA-N PubChem CID: 7319 SMILES: CC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]

Numero MDL MFCD00007174
PubChem CID 7319
Formula molecolare C8H7NO4
CAS 96-98-0
Molecular Weight (g/mol) 181.15
SMILES CC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]
InChI Key BBEWSMNRCUXQRF-UHFFFAOYSA-N
8

Methyl 4-fluoro-3-nitrobenzoate, 98%

CAS: 329-59-9 Formula molecolare: C8H6FNO4 Molecular Weight (g/mol): 199.14 Numero MDL: MFCD00196161 InChI Key: CNJJSTPBUHAEFH-UHFFFAOYSA-N Sinonimo: methyl 4-fluoro-3-nitro-benzoate,4-fluoro-3-nitrobenzoic acid methyl ester,4-fluoro-3-nitro-benzoic acid methyl ester,benzoic acid, 4-fluoro-3-nitro-, methyl ester,pubchem2045,acmc-209hxf,methyl 4-fluoro-3 nitrobenzoate,4-carbomethoxy-2-nitrofluorobenzene,methyl4-fluoro-3-nitrobenzoate PubChem CID: 5219721 IUPAC Name: methyl 4-fluoro-3-nitrobenzoate SMILES: COC(=O)C1=CC(=C(F)C=C1)[N+]([O-])=O

Sinonimo methyl 4-fluoro-3-nitro-benzoate,4-fluoro-3-nitrobenzoic acid methyl ester,4-fluoro-3-nitro-benzoic acid methyl ester,benzoic acid, 4-fluoro-3-nitro-, methyl ester,pubchem2045,acmc-209hxf,methyl 4-fluoro-3 nitrobenzoate,4-carbomethoxy-2-nitrofluorobenzene,methyl4-fluoro-3-nitrobenzoate
Numero MDL MFCD00196161
PubChem CID 5219721
Formula molecolare C8H6FNO4
CAS 329-59-9
Molecular Weight (g/mol) 199.14
SMILES COC(=O)C1=CC(=C(F)C=C1)[N+]([O-])=O
IUPAC Name methyl 4-fluoro-3-nitrobenzoate
InChI Key CNJJSTPBUHAEFH-UHFFFAOYSA-N
9

3-Nitrophthalic acid, 95%

CAS: 603-11-2 Formula molecolare: C8H5NO6 Molecular Weight (g/mol): 211.13 InChI Key: KFIRODWJCYBBHY-UHFFFAOYSA-N Sinonimo: 3-nitrophthalic acid,3-nitrobenzene-1,2-dicarboxylic acid,phthalic acid, 3-nitro,1,2-benzenedicarboxylic acid, 3-nitro,3-nitro phthalic acid,3-nitro-phthalic acid,3-nitrophthalicacid,nitrophthalic acid,3-nitrophtalic acid,m-nitrophthalic acid PubChem CID: 69043 SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O

Sinonimo 3-nitrophthalic acid,3-nitrobenzene-1,2-dicarboxylic acid,phthalic acid, 3-nitro,1,2-benzenedicarboxylic acid, 3-nitro,3-nitro phthalic acid,3-nitro-phthalic acid,3-nitrophthalicacid,nitrophthalic acid,3-nitrophtalic acid,m-nitrophthalic acid
PubChem CID 69043
Formula molecolare C8H5NO6
CAS 603-11-2
Molecular Weight (g/mol) 211.13
SMILES C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O
InChI Key KFIRODWJCYBBHY-UHFFFAOYSA-N
10

2-Chloro-3-nitrobenzoic acid, 98%

CAS: 3970-35-2 Formula molecolare: C7H4ClNO4 Molecular Weight (g/mol): 201.57 Numero MDL: MFCD00007069 InChI Key: JRQDVRIQJJPHEQ-UHFFFAOYSA-N Sinonimo: 2-chloro-3-nitrobenzoic acid,2-chloro-3-nitro-benzoic acid,2-chloro-3-nitrobenzoicacid,benzoic acid, 2-chloro-3-nitro,2-chloro-3-carboxynitrobenzene,nitrochlorbenzoesaure,pubchem2100,acmc-1ctvl,2-chloro-3-nitrobenzic acid,2-chloro-3-nitrobezoic acid PubChem CID: 19870 SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])Cl)C(=O)O

Sinonimo 2-chloro-3-nitrobenzoic acid,2-chloro-3-nitro-benzoic acid,2-chloro-3-nitrobenzoicacid,benzoic acid, 2-chloro-3-nitro,2-chloro-3-carboxynitrobenzene,nitrochlorbenzoesaure,pubchem2100,acmc-1ctvl,2-chloro-3-nitrobenzic acid,2-chloro-3-nitrobezoic acid
Numero MDL MFCD00007069
PubChem CID 19870
Formula molecolare C7H4ClNO4
CAS 3970-35-2
Molecular Weight (g/mol) 201.57
SMILES C1=CC(=C(C(=C1)[N+](=O)[O-])Cl)C(=O)O
InChI Key JRQDVRIQJJPHEQ-UHFFFAOYSA-N
11

Ethyl 3-nitrobenzoate, 98+%

CAS: 618-98-4 Formula molecolare: C9H9NO4 Molecular Weight (g/mol): 195.174 Numero MDL: MFCD00014702 InChI Key: MKBIJCPQTPFQKQ-UHFFFAOYSA-N Sinonimo: ethyl m-nitrobenzoate,benzoic acid, 3-nitro-, ethyl ester,ethyl-m-nitrobenzoate,m-nitrobenzoic acid, ethyl ester,benzoic acid, m-nitro-, ethyl ester,acmc-20akzc,3-nitrobenzoic acid ethyl,benzoic acid, 3-nitro-,ethyl ester,benzoic acid, m-nitro-, ethyl ester 8ci,r---2-2-diphenylphosphino phenyl-4-phenyl-2-oxazoline PubChem CID: 69261 IUPAC Name: ethyl 3-nitrobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

Sinonimo ethyl m-nitrobenzoate,benzoic acid, 3-nitro-, ethyl ester,ethyl-m-nitrobenzoate,m-nitrobenzoic acid, ethyl ester,benzoic acid, m-nitro-, ethyl ester,acmc-20akzc,3-nitrobenzoic acid ethyl,benzoic acid, 3-nitro-,ethyl ester,benzoic acid, m-nitro-, ethyl ester 8ci,r---2-2-diphenylphosphino phenyl-4-phenyl-2-oxazoline
Numero MDL MFCD00014702
PubChem CID 69261
Formula molecolare C9H9NO4
CAS 618-98-4
Molecular Weight (g/mol) 195.174
SMILES CCOC(=O)C1=CC(=CC=C1)[N+](=O)[O-]
IUPAC Name ethyl 3-nitrobenzoate
InChI Key MKBIJCPQTPFQKQ-UHFFFAOYSA-N
12

2-Chloro-6-nitrobenzoic acid, 99%

CAS: 5344-49-0 Formula molecolare: C7H4ClNO4 Molecular Weight (g/mol): 201.562 Numero MDL: MFCD00100425 InChI Key: JYHOMEFOTKWQPN-UHFFFAOYSA-N Sinonimo: 2-chloro-6-nitrobenzoic acid,2-chloro-6-nitro-benzoic acid,6-chloro-2-nitrobenzoic acid,benzoic acid, 2-chloro-6-nitro,pubchem20037,6-chloro-2-nitrobenzo,acmc-209l7b,2-chloro-6-nitrobenzoicacid,2-carboxy-3-chloronitrobenzene,2-chloro-6-nitrobenzoic acid # PubChem CID: 79287 SMILES: C1=CC(=C(C(=C1)Cl)C(=O)O)[N+](=O)[O-]

Sinonimo 2-chloro-6-nitrobenzoic acid,2-chloro-6-nitro-benzoic acid,6-chloro-2-nitrobenzoic acid,benzoic acid, 2-chloro-6-nitro,pubchem20037,6-chloro-2-nitrobenzo,acmc-209l7b,2-chloro-6-nitrobenzoicacid,2-carboxy-3-chloronitrobenzene,2-chloro-6-nitrobenzoic acid #
Numero MDL MFCD00100425
PubChem CID 79287
Formula molecolare C7H4ClNO4
CAS 5344-49-0
Molecular Weight (g/mol) 201.562
SMILES C1=CC(=C(C(=C1)Cl)C(=O)O)[N+](=O)[O-]
InChI Key JYHOMEFOTKWQPN-UHFFFAOYSA-N
13

5-Nitrosalicylic acid, 99%

CAS: 96-97-9 Formula molecolare: C7H5NO5 Molecular Weight (g/mol): 183.12 Numero MDL: MFCD00007338 InChI Key: PPDRLQLKHRZIJC-UHFFFAOYSA-N Sinonimo: 5-nitrosalicylic acid,2-hydroxy-5-nitrobenzoic acid,anilotic acid,benzoic acid, 2-hydroxy-5-nitro,5-nitro-2-hydroxybenzoic acid,unii-82l9g7fyz3,2-hydroxy-5-nitro-benzoic acid,5-nitro-salicylic acid,salicylic acid, 5-nitro,5-nitro salicylic acid PubChem CID: 7318 ChEBI: CHEBI:61281 SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)O

Sinonimo 5-nitrosalicylic acid,2-hydroxy-5-nitrobenzoic acid,anilotic acid,benzoic acid, 2-hydroxy-5-nitro,5-nitro-2-hydroxybenzoic acid,unii-82l9g7fyz3,2-hydroxy-5-nitro-benzoic acid,5-nitro-salicylic acid,salicylic acid, 5-nitro,5-nitro salicylic acid
Numero MDL MFCD00007338
PubChem CID 7318
Formula molecolare C7H5NO5
CAS 96-97-9
Molecular Weight (g/mol) 183.12
ChEBI CHEBI:61281
SMILES C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)O
InChI Key PPDRLQLKHRZIJC-UHFFFAOYSA-N
14

3-Methyl-4-nitrobenzoic acid, 99%

CAS: 3113-71-1 Formula molecolare: C8H7NO4 Molecular Weight (g/mol): 181.15 Numero MDL: MFCD00007168 InChI Key: XDTTUTIFWDAMIX-UHFFFAOYSA-N PubChem CID: 18370 SMILES: CC1=C(C=CC(=C1)C(=O)O)[N+](=O)[O-]

Numero MDL MFCD00007168
PubChem CID 18370
Formula molecolare C8H7NO4
CAS 3113-71-1
Molecular Weight (g/mol) 181.15
SMILES CC1=C(C=CC(=C1)C(=O)O)[N+](=O)[O-]
InChI Key XDTTUTIFWDAMIX-UHFFFAOYSA-N
15

4-Methoxy-3-nitrobenzoic acid, 98%, Thermo Scientific™

CAS: 89-41-8 Formula molecolare: C8H7NO5 Molecular Weight (g/mol): 197.15 Numero MDL: MFCD00007256 InChI Key: ANXBDAFDZSXOPQ-UHFFFAOYSA-N Sinonimo: 4-methoxy-3-nitrobenzoic acid,3-nitro-4-methoxybenzoic acid,3-nitro-p-anisic acid,benzoic acid, 4-methoxy-3-nitro,unii-dd71o31olz,p-anisic acid, 3-nitro,dd71o31olz,4-methoxy-3-nitro benzoic acid,4-methoxy-3-nitro-benzoic acid,4-methoxy-3-nitrobenzoicacid PubChem CID: 66640 SMILES: COC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]

Sinonimo 4-methoxy-3-nitrobenzoic acid,3-nitro-4-methoxybenzoic acid,3-nitro-p-anisic acid,benzoic acid, 4-methoxy-3-nitro,unii-dd71o31olz,p-anisic acid, 3-nitro,dd71o31olz,4-methoxy-3-nitro benzoic acid,4-methoxy-3-nitro-benzoic acid,4-methoxy-3-nitrobenzoicacid
Numero MDL MFCD00007256
PubChem CID 66640
Formula molecolare C8H7NO5
CAS 89-41-8
Molecular Weight (g/mol) 197.15
SMILES COC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]
InChI Key ANXBDAFDZSXOPQ-UHFFFAOYSA-N