Organic oxoazanium compounds

Organic compounds that contain or are associated with an oxoazanium ion; oxoazanium ions have an oxygen atom bonded to a nitrogen atom via a double bond, and the nitrogen atom is bonded to two hydrogen atoms.

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31 – 45 of 646 results

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Nitromethane, 98+%

CAS: 75-52-5 Molecular Formula: CH3NO2 Molecular Weight (g/mol): 61.04 MDL Number: MFCD00007400 InChI Key: LYGJENNIWJXYER-UHFFFAOYSA-N Synonym: methane, nitro,nitrocarbol,nitrometan,nitrometan polish,nitro-methane,unii-ru5wg8c3f4,ccris 1205,hsdb 106,meno2,ru5wg8c3f4 PubChem CID: 6375 ChEBI: CHEBI:77701 IUPAC Name: nitromethane SMILES: C[N+]([O-])=O

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PubChem CID	6375
CAS	75-52-5
Molecular Weight (g/mol)	61.04
ChEBI	CHEBI:77701
MDL Number	MFCD00007400
SMILES	C[N+]([O-])=O
Synonym	methane, nitro,nitrocarbol,nitrometan,nitrometan polish,nitro-methane,unii-ru5wg8c3f4,ccris 1205,hsdb 106,meno2,ru5wg8c3f4
IUPAC Name	nitromethane
InChI Key	LYGJENNIWJXYER-UHFFFAOYSA-N
Molecular Formula	CH3NO2

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4-Nitrobenzonitrile, 97%

CAS: 619-72-7 Molecular Formula: C7H4N2O2 Molecular Weight (g/mol): 148.12 MDL Number: MFCD00007279 InChI Key: NKJIFDNZPGLLSH-UHFFFAOYSA-N Synonym: benzonitrile, 4-nitro,4-cyanonitrobenzene,p-nitrobenzonitrile,p-cyanonitrobenzene,benzonitrile, p-nitro,4-nitrobenzenecarbonitrile,1-nitro-4-cyanobenzene,4-nitro-benzonitrile,ccris 2328,4-nitrobenzonitril PubChem CID: 12090 IUPAC Name: 4-nitrobenzonitrile SMILES: [O-][N+](=O)C1=CC=C(C=C1)C#N

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PubChem CID	12090
CAS	619-72-7
Molecular Weight (g/mol)	148.12
MDL Number	MFCD00007279
SMILES	[O-][N+](=O)C1=CC=C(C=C1)C#N
Synonym	benzonitrile, 4-nitro,4-cyanonitrobenzene,p-nitrobenzonitrile,p-cyanonitrobenzene,benzonitrile, p-nitro,4-nitrobenzenecarbonitrile,1-nitro-4-cyanobenzene,4-nitro-benzonitrile,ccris 2328,4-nitrobenzonitril
IUPAC Name	4-nitrobenzonitrile
InChI Key	NKJIFDNZPGLLSH-UHFFFAOYSA-N
Molecular Formula	C7H4N2O2

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6-Nitrochromone, 97%

CAS: 51484-05-0 Molecular Formula: C9H5NO4 Molecular Weight (g/mol): 191.142 MDL Number: MFCD02954226 InChI Key: ORWADBVBOPTYQT-UHFFFAOYSA-N Synonym: 6-nitrochromone,6-nitro-4h-chromen-4-one,6-nitrobenzopyran-4-one,acmc-20alxw,6-nitro-4-oxo-4h-1-benzopyran,6-nitro-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one,6-nitro PubChem CID: 847716 IUPAC Name: 6-nitrochromen-4-one SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C=CO2

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PubChem CID	847716
CAS	51484-05-0
Molecular Weight (g/mol)	191.142
MDL Number	MFCD02954226
SMILES	C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C=CO2
Synonym	6-nitrochromone,6-nitro-4h-chromen-4-one,6-nitrobenzopyran-4-one,acmc-20alxw,6-nitro-4-oxo-4h-1-benzopyran,6-nitro-4h-1-benzopyran-4-one,4h-1-benzopyran-4-one,6-nitro
IUPAC Name	6-nitrochromen-4-one
InChI Key	ORWADBVBOPTYQT-UHFFFAOYSA-N
Molecular Formula	C9H5NO4

2-Nitrophenylacetic acid, 99%

CAS: 3740-52-1 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.15 MDL Number: MFCD00007190 InChI Key: WMUZDBZPDLHUMW-UHFFFAOYSA-N Synonym: 2-nitrophenylacetic acid,2-2-nitrophenyl acetic acid,2-nitrophenyl acetic acid,o-nitrophenylacetic acid,benzeneacetic acid, 2-nitro,acetic acid, o-nitrophenyl,ortho-nitrophenyl acetic acid,2-o-nitrophenyl acetic acid,2-nitrobenzeneacetic acid,unii-05tn0suy38 PubChem CID: 77337 IUPAC Name: 2-(2-nitrophenyl)acetic acid SMILES: OC(=O)CC1=CC=CC=C1[N+]([O-])=O

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PubChem CID	77337
CAS	3740-52-1
Molecular Weight (g/mol)	181.15
MDL Number	MFCD00007190
SMILES	OC(=O)CC1=CC=CC=C1[N+]([O-])=O
Synonym	2-nitrophenylacetic acid,2-2-nitrophenyl acetic acid,2-nitrophenyl acetic acid,o-nitrophenylacetic acid,benzeneacetic acid, 2-nitro,acetic acid, o-nitrophenyl,ortho-nitrophenyl acetic acid,2-o-nitrophenyl acetic acid,2-nitrobenzeneacetic acid,unii-05tn0suy38
IUPAC Name	2-(2-nitrophenyl)acetic acid
InChI Key	WMUZDBZPDLHUMW-UHFFFAOYSA-N
Molecular Formula	C8H7NO4

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7-Nitroindole-2-carboxylic acid, 96%

CAS: 6960-45-8 Molecular Formula: C9H6N2O4 Molecular Weight (g/mol): 206.157 MDL Number: MFCD00044720 InChI Key: BIUCOFQROHIAEO-UHFFFAOYSA-N Synonym: 7-nitro-1h-indole-2-carboxylic acid,7-nitroindole-2-carboxylic acid,1h-indole-2-carboxylic acid, 7-nitro,7-nitroindole-2-carboxylicacid,dna base excision repair pathway inhibitor,maybridge1_004786,indole-2-carboxylic acid, 7-nitro,pubchem9857,acmc-1b8pb,1h-indole-2-carboxylicacid, 7-nitro PubChem CID: 81409 SMILES: C1=CC2=C(C(=C1)[N+](=O)[O-])NC(=C2)C(=O)O

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PubChem CID	81409
CAS	6960-45-8
Molecular Weight (g/mol)	206.157
MDL Number	MFCD00044720
SMILES	C1=CC2=C(C(=C1)[N+](=O)[O-])NC(=C2)C(=O)O
Synonym	7-nitro-1h-indole-2-carboxylic acid,7-nitroindole-2-carboxylic acid,1h-indole-2-carboxylic acid, 7-nitro,7-nitroindole-2-carboxylicacid,dna base excision repair pathway inhibitor,maybridge1_004786,indole-2-carboxylic acid, 7-nitro,pubchem9857,acmc-1b8pb,1h-indole-2-carboxylicacid, 7-nitro
InChI Key	BIUCOFQROHIAEO-UHFFFAOYSA-N
Molecular Formula	C9H6N2O4

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1-Chloro-2-fluoro-3-nitrobenzene, 97%

CAS: 2106-49-2 Molecular Formula: C6H3ClFNO2 Molecular Weight (g/mol): 175.54 MDL Number: MFCD00069417 InChI Key: RBAHXNSORRGCQA-UHFFFAOYSA-N Synonym: 3-chloro-2-fluoronitrobenzene,2-fluoro-3-chloronitrobenzene,1-chloro-2-fluoro-3-nitro-benzene,2-fluoro-3-chloro-nitrobenzene,benzene, chlorofluoronitro,ccris 9050,3-chloro-2-fluoro-1-nitrobenzene,pubchem2483,chlorofluoronitrobenzene,acmc-1bn8r PubChem CID: 75016 IUPAC Name: 1-chloro-2-fluoro-3-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC(Cl)=C1F

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PubChem CID	75016
CAS	2106-49-2
Molecular Weight (g/mol)	175.54
MDL Number	MFCD00069417
SMILES	[O-][N+](=O)C1=CC=CC(Cl)=C1F
Synonym	3-chloro-2-fluoronitrobenzene,2-fluoro-3-chloronitrobenzene,1-chloro-2-fluoro-3-nitro-benzene,2-fluoro-3-chloro-nitrobenzene,benzene, chlorofluoronitro,ccris 9050,3-chloro-2-fluoro-1-nitrobenzene,pubchem2483,chlorofluoronitrobenzene,acmc-1bn8r
IUPAC Name	1-chloro-2-fluoro-3-nitrobenzene
InChI Key	RBAHXNSORRGCQA-UHFFFAOYSA-N
Molecular Formula	C6H3ClFNO2

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trans-beta-Methyl-beta-nitrostyrene, 99%

CAS: 705-60-2 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.18 MDL Number: MFCD00014720 InChI Key: WGSVFWFSJDAYBM-BQYQJAHWSA-N Synonym: 1-phenyl-2-nitropropene,2-nitroprop-1-en-1-yl benzene,2-nitro-1-propenyl benzene,2-nitropropenyl benzene,benzene, 2-nitro-1-propenyl,benzene, 2-nitropropenyl,1-2-nitropropenyl benzene,caswell no. 604,trans-beta-methyl-beta-nitrostyrene PubChem CID: 1549520 IUPAC Name: [(E)-2-nitroprop-1-enyl]benzene SMILES: C\C(=C/C1=CC=CC=C1)[N+]([O-])=O

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PubChem CID	1549520
CAS	705-60-2
Molecular Weight (g/mol)	163.18
MDL Number	MFCD00014720
SMILES	C\C(=C/C1=CC=CC=C1)[N+]([O-])=O
Synonym	1-phenyl-2-nitropropene,2-nitroprop-1-en-1-yl benzene,2-nitro-1-propenyl benzene,2-nitropropenyl benzene,benzene, 2-nitro-1-propenyl,benzene, 2-nitropropenyl,1-2-nitropropenyl benzene,caswell no. 604,trans-beta-methyl-beta-nitrostyrene
IUPAC Name	[(E)-2-nitroprop-1-enyl]benzene
InChI Key	WGSVFWFSJDAYBM-BQYQJAHWSA-N
Molecular Formula	C9H9NO2

5-Nitroindole, 99%

CAS: 6146-52-7 Molecular Formula: C₈H₆N₂O₂ Molecular Weight (g/mol): 162.15 MDL Number: MFCD00005673 InChI Key: OZFPSOBLQZPIAV-UHFFFAOYSA-N Synonym: 5-nitroindole,1h-indole, 5-nitro,indole, 5-nitro,unii-o2bhx6edbn,5-nitro indole,ccris 3255,o2bhx6edbn,pubchem1711,acmc-209msr PubChem CID: 22523 IUPAC Name: 5-nitro-1H-indole SMILES: C1=CC2=C(C=CN2)C=C1[N+](=O)[O-]

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PubChem CID	22523
CAS	6146-52-7
Molecular Weight (g/mol)	162.15
MDL Number	MFCD00005673
SMILES	C1=CC2=C(C=CN2)C=C1[N+](=O)[O-]
Synonym	5-nitroindole,1h-indole, 5-nitro,indole, 5-nitro,unii-o2bhx6edbn,5-nitro indole,ccris 3255,o2bhx6edbn,pubchem1711,acmc-209msr
IUPAC Name	5-nitro-1H-indole
InChI Key	OZFPSOBLQZPIAV-UHFFFAOYSA-N
Molecular Formula	C₈H₆N₂O₂

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4-Nitrophenyl chloroformate, 97%

CAS: 7693-46-1 Molecular Formula: C7H4ClNO4 Molecular Weight (g/mol): 201.562 MDL Number: MFCD00007321 InChI Key: NXLNNXIXOYSCMB-UHFFFAOYSA-N Synonym: 4-nitrophenyl chloroformate,carbonochloridic acid, 4-nitrophenyl ester,chloroformic acid 4-nitrophenyl ester,p-nitrophenyl chloroformate,chloroformic acid p-nitrophenyl ester,4-nitrophenyl carbonochloridate,formic acid, chloro-, p-nitrophenyl ester,4-nitrophenylchlorocarbonat,4-nitrophenyl choroformate PubChem CID: 82129 IUPAC Name: (4-nitrophenyl) carbonochloridate SMILES: C1=CC(=CC=C1[N+](=O)[O-])OC(=O)Cl

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PubChem CID	82129
CAS	7693-46-1
Molecular Weight (g/mol)	201.562
MDL Number	MFCD00007321
SMILES	C1=CC(=CC=C1[N+](=O)[O-])OC(=O)Cl
Synonym	4-nitrophenyl chloroformate,carbonochloridic acid, 4-nitrophenyl ester,chloroformic acid 4-nitrophenyl ester,p-nitrophenyl chloroformate,chloroformic acid p-nitrophenyl ester,4-nitrophenyl carbonochloridate,formic acid, chloro-, p-nitrophenyl ester,4-nitrophenylchlorocarbonat,4-nitrophenyl choroformate
IUPAC Name	(4-nitrophenyl) carbonochloridate
InChI Key	NXLNNXIXOYSCMB-UHFFFAOYSA-N
Molecular Formula	C7H4ClNO4

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1-Chloro-4-nitrobenzene, 99%

CAS: 100-00-5 Molecular Formula: C₆H₄ClNO₂ Molecular Weight (g/mol): 157.56 MDL Number: MFCD00007285 InChI Key: CZGCEKJOLUNIFY-UHFFFAOYSA-N Synonym: 4-chloronitrobenzene,p-chloronitrobenzene,p-nitrochlorobenzene,benzene, 1-chloro-4-nitro,4-nitrochlorobenzene,pncb,4-chloro-1-nitrobenzene,p-nitrophenyl chloride,p-nitrochlorobenzol,p-nitroclorobenzene PubChem CID: 7474 ChEBI: CHEBI:34399 IUPAC Name: 1-chloro-4-nitrobenzene SMILES: C1=CC(=CC=C1[N+](=O)[O-])Cl

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PubChem CID	7474
CAS	100-00-5
Molecular Weight (g/mol)	157.56
ChEBI	CHEBI:34399
MDL Number	MFCD00007285
SMILES	C1=CC(=CC=C1[N+](=O)[O-])Cl
Synonym	4-chloronitrobenzene,p-chloronitrobenzene,p-nitrochlorobenzene,benzene, 1-chloro-4-nitro,4-nitrochlorobenzene,pncb,4-chloro-1-nitrobenzene,p-nitrophenyl chloride,p-nitrochlorobenzol,p-nitroclorobenzene
IUPAC Name	1-chloro-4-nitrobenzene
InChI Key	CZGCEKJOLUNIFY-UHFFFAOYSA-N
Molecular Formula	C₆H₄ClNO₂

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1-Fluoro-3-nitrobenzene, 98+%

CAS: 402-67-5 Molecular Formula: C6H4FNO2 Molecular Weight (g/mol): 141.10 MDL Number: MFCD00007196 InChI Key: WMASLRCNNKMRFP-UHFFFAOYSA-N Synonym: 3-fluoronitrobenzene,m-fluoronitrobenzene,m-nitrofluorobenzene,benzene, 1-fluoro-3-nitro,3-fluoro-1-nitrobenzene,1-fluoro-3-nitro-benzene,3-fluoro-nitrobenzene,3-nitro-fluorobenzene,pubchem2286,3-fluoro nitro benzene PubChem CID: 9823 IUPAC Name: 1-fluoro-3-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC(F)=C1

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PubChem CID	9823
CAS	402-67-5
Molecular Weight (g/mol)	141.10
MDL Number	MFCD00007196
SMILES	[O-][N+](=O)C1=CC=CC(F)=C1
Synonym	3-fluoronitrobenzene,m-fluoronitrobenzene,m-nitrofluorobenzene,benzene, 1-fluoro-3-nitro,3-fluoro-1-nitrobenzene,1-fluoro-3-nitro-benzene,3-fluoro-nitrobenzene,3-nitro-fluorobenzene,pubchem2286,3-fluoro nitro benzene
IUPAC Name	1-fluoro-3-nitrobenzene
InChI Key	WMASLRCNNKMRFP-UHFFFAOYSA-N
Molecular Formula	C6H4FNO2

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2-Nitrobenzenesulfenyl chloride, 97%

CAS: 7669-54-7 Molecular Formula: C6H4ClNO2S Molecular Weight (g/mol): 189.613 MDL Number: MFCD00007128 InChI Key: NTNKNFHIAFDCSJ-UHFFFAOYSA-N Synonym: 2-nitrobenzenesulfenyl chloride,2-nitrophenylsulfenyl chloride,benzenesulfenyl chloride, 2-nitro,o-nitrobenzenesulfenyl chloride,o-nitrophenylsulfenyl chloride,2-nitrobenzenesulfenylchloride,o-nitrophenylsulphenyl chloride,o-nitrobenzenesulphenyl chloride,2-nitrophenyl thiohypochlorite,2-nitrophenyl sulfanyl chlorane PubChem CID: 24319 IUPAC Name: (2-nitrophenyl) thiohypochlorite SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])SCl

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PubChem CID	24319
CAS	7669-54-7
Molecular Weight (g/mol)	189.613
MDL Number	MFCD00007128
SMILES	C1=CC=C(C(=C1)[N+](=O)[O-])SCl
Synonym	2-nitrobenzenesulfenyl chloride,2-nitrophenylsulfenyl chloride,benzenesulfenyl chloride, 2-nitro,o-nitrobenzenesulfenyl chloride,o-nitrophenylsulfenyl chloride,2-nitrobenzenesulfenylchloride,o-nitrophenylsulphenyl chloride,o-nitrobenzenesulphenyl chloride,2-nitrophenyl thiohypochlorite,2-nitrophenyl sulfanyl chlorane
IUPAC Name	(2-nitrophenyl) thiohypochlorite
InChI Key	NTNKNFHIAFDCSJ-UHFFFAOYSA-N
Molecular Formula	C6H4ClNO2S

PubChem CID	6375
CAS	75-52-5
Molecular Weight (g/mol)	61.04
ChEBI	CHEBI:77701
MDL Number	MFCD00007400
SMILES	C[N+]([O-])=O
Synonym	methane, nitro,nitrocarbol,nitrometan,nitrometan polish,nitro-methane,unii-ru5wg8c3f4,ccris 1205,hsdb 106,meno2,ru5wg8c3f4
IUPAC Name	nitromethane
InChI Key	LYGJENNIWJXYER-UHFFFAOYSA-N
Molecular Formula	CH3NO2

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2,4-Dichloro-5-nitropyrimidine, 97%

CAS: 49845-33-2 Molecular Formula: C4HCl2N3O2 Molecular Weight (g/mol): 193.97 MDL Number: MFCD00127867 InChI Key: INUSQTPGSHFGHM-UHFFFAOYSA-N Synonym: 2,4-dichloro-5-nitro-pyrimidine,pyrimidine, 2,4-dichloro-5-nitro,2, 4-dichloro-5-nitropyrimidine,3-nitro-2,4-dichloropyrimidine,2,4-dichloro-5-nitro pyrimidine,zlchem 540,pubchem7079,acmc-1ann4,ksc236i7h,2,4-dichloro5-nitropyrimidine PubChem CID: 521266 IUPAC Name: 2,4-dichloro-5-nitropyrimidine SMILES: [O-][N+](=O)C1=CN=C(Cl)N=C1Cl

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Specifications

PubChem CID	521266
CAS	49845-33-2
Molecular Weight (g/mol)	193.97
MDL Number	MFCD00127867
SMILES	[O-][N+](=O)C1=CN=C(Cl)N=C1Cl
Synonym	2,4-dichloro-5-nitro-pyrimidine,pyrimidine, 2,4-dichloro-5-nitro,2, 4-dichloro-5-nitropyrimidine,3-nitro-2,4-dichloropyrimidine,2,4-dichloro-5-nitro pyrimidine,zlchem 540,pubchem7079,acmc-1ann4,ksc236i7h,2,4-dichloro5-nitropyrimidine
IUPAC Name	2,4-dichloro-5-nitropyrimidine
InChI Key	INUSQTPGSHFGHM-UHFFFAOYSA-N
Molecular Formula	C4HCl2N3O2

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5-Nitroindole-2-carboxylic acid, 96%

CAS: 16730-20-4 Molecular Formula: C9H6N2O4 Molecular Weight (g/mol): 206.157 MDL Number: MFCD00236372 InChI Key: LHFOJSCXLFKDIR-UHFFFAOYSA-N Synonym: 5-nitroindole-2-carboxylic acid,5-nitro-1h-indole-2-carboxylic acid,1h-indole-2-carboxylic acid, 5-nitro,5-nitro-2-indolecarboxylic acid,1h-indole-2-carboxylicacid, 5-nitro,5-nitroindole-2-carboxylicacid,pubchem1710,zlchem 1340,5-nitro indole-2-carboxylic acid PubChem CID: 351291 SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C=C(N2)C(=O)O

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PubChem CID	351291
CAS	16730-20-4
Molecular Weight (g/mol)	206.157
MDL Number	MFCD00236372
SMILES	C1=CC2=C(C=C1[N+](=O)[O-])C=C(N2)C(=O)O
Synonym	5-nitroindole-2-carboxylic acid,5-nitro-1h-indole-2-carboxylic acid,1h-indole-2-carboxylic acid, 5-nitro,5-nitro-2-indolecarboxylic acid,1h-indole-2-carboxylicacid, 5-nitro,5-nitroindole-2-carboxylicacid,pubchem1710,zlchem 1340,5-nitro indole-2-carboxylic acid
InChI Key	LHFOJSCXLFKDIR-UHFFFAOYSA-N
Molecular Formula	C9H6N2O4

Organic oxoazanium compounds

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