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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46 – 60 of 482 results

4-Fluoro-3-nitroaniline, 99%

CAS: 364-76-1 Molecular Formula: C6H5FN2O2 Molecular Weight (g/mol): 156.12 MDL Number: MFCD00007833 InChI Key: LLIOADBCFIXIEU-UHFFFAOYSA-N Synonym: 3-nitro-4-fluoroaniline,4-fluoro-3-nitrobenzenamine,benzenamine, 4-fluoro-3-nitro,aniline, 4-fluoro-3-nitro,4-fluoro-3-nitro-aniline,5-amino-2-fluoronitrobenzene,4-fluoro-3-nitro-phenylamine,3-nitro-4-fluoroanailine,3-nitro-4-fluoro aniline,4-fluoro-3-nitro aniline PubChem CID: 67768 ChEBI: CHEBI:48642 IUPAC Name: 4-fluoro-3-nitroaniline SMILES: NC1=CC=C(F)C(=C1)[N+]([O-])=O

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Specifications

PubChem CID	67768
CAS	364-76-1
Molecular Weight (g/mol)	156.12
ChEBI	CHEBI:48642
MDL Number	MFCD00007833
SMILES	NC1=CC=C(F)C(=C1)[N+]([O-])=O
Synonym	3-nitro-4-fluoroaniline,4-fluoro-3-nitrobenzenamine,benzenamine, 4-fluoro-3-nitro,aniline, 4-fluoro-3-nitro,4-fluoro-3-nitro-aniline,5-amino-2-fluoronitrobenzene,4-fluoro-3-nitro-phenylamine,3-nitro-4-fluoroanailine,3-nitro-4-fluoro aniline,4-fluoro-3-nitro aniline
IUPAC Name	4-fluoro-3-nitroaniline
InChI Key	LLIOADBCFIXIEU-UHFFFAOYSA-N
Molecular Formula	C6H5FN2O2

Nitromethane, 99%, pure

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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Specifications

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

2-Fluoro-5-nitrobenzonitrile, 98+%

CAS: 17417-09-3 Molecular Formula: C7H3FN2O2 Molecular Weight (g/mol): 166.11 MDL Number: MFCD00042299 InChI Key: YLACBMHBZVYOAP-UHFFFAOYSA-N Synonym: benzonitrile, 2-fluoro-5-nitro,3-cyano-4-fluoronitrobenzene,2-fluoro-5-nitro-benzonitrile,2-fluoro-5-nitrobenzenecarbonitrile,2-fluoro-5-nitrobenzenenitrile,3-cyano-4-fluoro-1-nitrobenzene,pubchem4792,intermediates-zcf02297,acmc-209e7w,5-nitro-2-fluorobenzonitrile PubChem CID: 519417 IUPAC Name: 2-fluoro-5-nitrobenzonitrile SMILES: [O-][N+](=O)C1=CC=C(F)C(=C1)C#N

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Specifications

PubChem CID	519417
CAS	17417-09-3
Molecular Weight (g/mol)	166.11
MDL Number	MFCD00042299
SMILES	[O-][N+](=O)C1=CC=C(F)C(=C1)C#N
Synonym	benzonitrile, 2-fluoro-5-nitro,3-cyano-4-fluoronitrobenzene,2-fluoro-5-nitro-benzonitrile,2-fluoro-5-nitrobenzenecarbonitrile,2-fluoro-5-nitrobenzenenitrile,3-cyano-4-fluoro-1-nitrobenzene,pubchem4792,intermediates-zcf02297,acmc-209e7w,5-nitro-2-fluorobenzonitrile
IUPAC Name	2-fluoro-5-nitrobenzonitrile
InChI Key	YLACBMHBZVYOAP-UHFFFAOYSA-N
Molecular Formula	C7H3FN2O2

1-Chloro-2-nitrobenzene, 99%

CAS: 88-73-3 Molecular Formula: C6H4ClNO2 Molecular Weight (g/mol): 157.55 MDL Number: MFCD00007061 InChI Key: BFCFYVKQTRLZHA-UHFFFAOYSA-N Synonym: 2-chloronitrobenzene,o-chloronitrobenzene,2-nitrochlorobenzene,chloronitrobenzene,o-nitrochlorobenzene,benzene, 1-chloro-2-nitro,2-chloro-1-nitrobenzene,oncb,benzene, chloronitro,nitrochlorobenzene PubChem CID: 6945 ChEBI: CHEBI:34270 IUPAC Name: 1-chloro-2-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC=C1Cl

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Specifications

PubChem CID	6945
CAS	88-73-3
Molecular Weight (g/mol)	157.55
ChEBI	CHEBI:34270
MDL Number	MFCD00007061
SMILES	[O-][N+](=O)C1=CC=CC=C1Cl
Synonym	2-chloronitrobenzene,o-chloronitrobenzene,2-nitrochlorobenzene,chloronitrobenzene,o-nitrochlorobenzene,benzene, 1-chloro-2-nitro,2-chloro-1-nitrobenzene,oncb,benzene, chloronitro,nitrochlorobenzene
IUPAC Name	1-chloro-2-nitrobenzene
InChI Key	BFCFYVKQTRLZHA-UHFFFAOYSA-N
Molecular Formula	C6H4ClNO2

p-Fluoronitrobenzene, MP Biomedicals

CAS: 350-46-9 Molecular Formula: C6H4FNO2 Molecular Weight (g/mol): 141.101 InChI Key: WFQDTOYDVUWQMS-UHFFFAOYSA-N Synonym: 4-fluoronitrobenzene,p-fluoronitrobenzene,p-nitrofluorobenzene,benzene, 1-fluoro-4-nitro,4-nitrofluorobenzene,1-nitro-4-fluorobenzene,4-fluoro-1-nitrobenzene,1-fluoro-4-nitro-benzene,unii-a2m2fh7xhh,p-fluoro nitrobenzene PubChem CID: 9590 IUPAC Name: 1-fluoro-4-nitrobenzene SMILES: C1=CC(=CC=C1[N+](=O)[O-])F

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Specifications

PubChem CID	9590
CAS	350-46-9
Molecular Weight (g/mol)	141.101
SMILES	C1=CC(=CC=C1[N+](=O)[O-])F
Synonym	4-fluoronitrobenzene,p-fluoronitrobenzene,p-nitrofluorobenzene,benzene, 1-fluoro-4-nitro,4-nitrofluorobenzene,1-nitro-4-fluorobenzene,4-fluoro-1-nitrobenzene,1-fluoro-4-nitro-benzene,unii-a2m2fh7xhh,p-fluoro nitrobenzene
IUPAC Name	1-fluoro-4-nitrobenzene
InChI Key	WFQDTOYDVUWQMS-UHFFFAOYSA-N
Molecular Formula	C6H4FNO2

4-(4-Nitrobenzyl)pyridine, 98%

CAS: 1083-48-3 Molecular Formula: C12H10N2O2 Molecular Weight (g/mol): 214.22 MDL Number: MFCD00006445 InChI Key: MNHKUCBXXMFQDM-UHFFFAOYSA-N Synonym: 4-4-nitrobenzyl pyridine,4-4-nitrophenyl methyl pyridine,pyridine, 4-4-nitrophenyl methyl,pyridine, 4-p-nitrobenzyl,1-p-nitrobenzyl pyridine,4-p-nitrobenzyl pyridine,4 4-nitrobenzyl primide,unii-0z6gs37n7h,gamma-p-nitrobenzyl pyridine PubChem CID: 14129 IUPAC Name: 4-[(4-nitrophenyl)methyl]pyridine SMILES: [O-][N+](=O)C1=CC=C(CC2=CC=NC=C2)C=C1

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Specifications

PubChem CID	14129
CAS	1083-48-3
Molecular Weight (g/mol)	214.22
MDL Number	MFCD00006445
SMILES	[O-][N+](=O)C1=CC=C(CC2=CC=NC=C2)C=C1
Synonym	4-4-nitrobenzyl pyridine,4-4-nitrophenyl methyl pyridine,pyridine, 4-4-nitrophenyl methyl,pyridine, 4-p-nitrobenzyl,1-p-nitrobenzyl pyridine,4-p-nitrobenzyl pyridine,4 4-nitrobenzyl primide,unii-0z6gs37n7h,gamma-p-nitrobenzyl pyridine
IUPAC Name	4-[(4-nitrophenyl)methyl]pyridine
InChI Key	MNHKUCBXXMFQDM-UHFFFAOYSA-N
Molecular Formula	C12H10N2O2

7-Nitroindole-2-carboxylic acid, 90%, Thermo Scientific™

CAS: 6960-45-8 Molecular Formula: C9H6N2O4 Molecular Weight (g/mol): 206.157 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
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

6-Nitrobenzothiazole, 98+%

CAS: 2942-06-5 Molecular Formula: C7H4N2O2S Molecular Weight (g/mol): 180.18 MDL Number: MFCD00014569 InChI Key: QLUFBCVWKTWKBF-UHFFFAOYSA-N IUPAC Name: 6-nitro-1,3-benzothiazole

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Specifications

CAS	2942-06-5
Molecular Weight (g/mol)	180.18
MDL Number	MFCD00014569
IUPAC Name	6-nitro-1,3-benzothiazole
InChI Key	QLUFBCVWKTWKBF-UHFFFAOYSA-N
Molecular Formula	C7H4N2O2S

3,5-Dichloro-4-fluoro-1-nitrobenzene, 95%

CAS: 3107-19-5 Molecular Formula: C6H2Cl2FNO2 Molecular Weight (g/mol): 209.99 MDL Number: MFCD00129963 InChI Key: VMAATSFMXSMKPG-UHFFFAOYSA-N Synonym: 3,5-dichloro-4-fluoronitrobenzene,benzene, 1,3-dichloro-2-fluoro-5-nitro,2,6-dichloro-4-nitrofluorobenzene,zlchem 371,pubchem4387,acmc-209hk6,ksc495g6p,3,5-dichloro-4-fluoro-1-nitrobenzene,1,3-dichloro-2-fluoro-5-nitro-benzene PubChem CID: 76554 IUPAC Name: 1,3-dichloro-2-fluoro-5-nitrobenzene SMILES: [O-][N+](=O)C1=CC(Cl)=C(F)C(Cl)=C1

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Specifications

PubChem CID	76554
CAS	3107-19-5
Molecular Weight (g/mol)	209.99
MDL Number	MFCD00129963
SMILES	[O-][N+](=O)C1=CC(Cl)=C(F)C(Cl)=C1
Synonym	3,5-dichloro-4-fluoronitrobenzene,benzene, 1,3-dichloro-2-fluoro-5-nitro,2,6-dichloro-4-nitrofluorobenzene,zlchem 371,pubchem4387,acmc-209hk6,ksc495g6p,3,5-dichloro-4-fluoro-1-nitrobenzene,1,3-dichloro-2-fluoro-5-nitro-benzene
IUPAC Name	1,3-dichloro-2-fluoro-5-nitrobenzene
InChI Key	VMAATSFMXSMKPG-UHFFFAOYSA-N
Molecular Formula	C6H2Cl2FNO2

3-Nitrophthalic anhydride, 97%

CAS: 641-70-3 Molecular Formula: C8H3NO5 Molecular Weight (g/mol): 193.11 MDL Number: MFCD00005921 InChI Key: ROFZMKDROVBLNY-UHFFFAOYSA-N Synonym: 3-nitrophthalic anhydride,4-nitroisobenzofuran-1,3-dione,1,3-isobenzofurandione, 4-nitro,phthalic anhydride, 3-nitro,3-nitro phthalic anhydride,3-nitrophthalic acid anhydride,1,3-isobenzofurandione, nitro,4-nitro-isobenzofuran-1,3-dione,3-nitrophthalicanhydride,nitrophthalic anhydride PubChem CID: 21631 IUPAC Name: 4-nitro-2-benzofuran-1,3-dione SMILES: [O-][N+](=O)C1=CC=CC2=C1C(=O)OC2=O

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Specifications

PubChem CID	21631
CAS	641-70-3
Molecular Weight (g/mol)	193.11
MDL Number	MFCD00005921
SMILES	[O-][N+](=O)C1=CC=CC2=C1C(=O)OC2=O
Synonym	3-nitrophthalic anhydride,4-nitroisobenzofuran-1,3-dione,1,3-isobenzofurandione, 4-nitro,phthalic anhydride, 3-nitro,3-nitro phthalic anhydride,3-nitrophthalic acid anhydride,1,3-isobenzofurandione, nitro,4-nitro-isobenzofuran-1,3-dione,3-nitrophthalicanhydride,nitrophthalic anhydride
IUPAC Name	4-nitro-2-benzofuran-1,3-dione
InChI Key	ROFZMKDROVBLNY-UHFFFAOYSA-N
Molecular Formula	C8H3NO5

4-Nitrobenzenediazonium tetrafluoroborate, 97%

CAS: 456-27-9 Molecular Formula: C6H4BF4N3O2 Molecular Weight (g/mol): 236.92 MDL Number: MFCD00012005 InChI Key: AFULQCYCQAHYIP-UHFFFAOYSA-N Synonym: 4-nitrobenzenediazonium tetrafluoroborate,ccris 3641,unii-2uxo615r4o,p-nitrobenzenediazonium tetrafluoroborate,benzenediazonium, 4-nitro-, tetrafluoroborate 1-,p-nitrophenyldiazonium fluoborate,p-nitrobenzenediazonium fluoborate,4-nitrobenzenediazonium fluoborate,p-nitrobenzenediazonium fluoroborate,4-nitrobenzenediazonium fluoroborate PubChem CID: 68006 IUPAC Name: 4-nitrobenzenediazonium;tetrafluoroborate SMILES: F[B-](F)(F)F.[O-][N+](=O)C1=CC=C(C=C1)[N+]#N

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Specifications

PubChem CID	68006
CAS	456-27-9
Molecular Weight (g/mol)	236.92
MDL Number	MFCD00012005
SMILES	F[B-](F)(F)F.[O-][N+](=O)C1=CC=C(C=C1)[N+]#N
Synonym	4-nitrobenzenediazonium tetrafluoroborate,ccris 3641,unii-2uxo615r4o,p-nitrobenzenediazonium tetrafluoroborate,benzenediazonium, 4-nitro-, tetrafluoroborate 1-,p-nitrophenyldiazonium fluoborate,p-nitrobenzenediazonium fluoborate,4-nitrobenzenediazonium fluoborate,p-nitrobenzenediazonium fluoroborate,4-nitrobenzenediazonium fluoroborate
IUPAC Name	4-nitrobenzenediazonium;tetrafluoroborate
InChI Key	AFULQCYCQAHYIP-UHFFFAOYSA-N
Molecular Formula	C6H4BF4N3O2

1,4-Dinitrobenzene, 98+%

CAS: 100-25-4 Molecular Formula: C6H4N2O4 Molecular Weight (g/mol): 168.108 MDL Number: MFCD00007314 InChI Key: FYFDQJRXFWGIBS-UHFFFAOYSA-N Synonym: p-dinitrobenzene,benzene, 1,4-dinitro,benzene, p-dinitro,dithane a-4,dinitrobenzene, p,dinitrobenzene, para,ccris 3092,1,4-dinitro-benzene,1,4-dinitrobenzene, analytical standard,para-dinitrobenzene PubChem CID: 7492 ChEBI: CHEBI:51398 IUPAC Name: 1,4-dinitrobenzene SMILES: C1=CC(=CC=C1[N+](=O)[O-])[N+](=O)[O-]

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Specifications

PubChem CID	7492
CAS	100-25-4
Molecular Weight (g/mol)	168.108
ChEBI	CHEBI:51398
MDL Number	MFCD00007314
SMILES	C1=CC(=CC=C1[N+](=O)[O-])[N+](=O)[O-]
Synonym	p-dinitrobenzene,benzene, 1,4-dinitro,benzene, p-dinitro,dithane a-4,dinitrobenzene, p,dinitrobenzene, para,ccris 3092,1,4-dinitro-benzene,1,4-dinitrobenzene, analytical standard,para-dinitrobenzene
IUPAC Name	1,4-dinitrobenzene
InChI Key	FYFDQJRXFWGIBS-UHFFFAOYSA-N
Molecular Formula	C6H4N2O4

3-Nitrobenzonitrile, 98%

CAS: 619-24-9 Molecular Formula: C7H4N2O2 Molecular Weight (g/mol): 148.121 MDL Number: MFCD00007194 InChI Key: RUSAWEHOGCWOPG-UHFFFAOYSA-N Synonym: benzonitrile, 3-nitro,m-nitrobenzonitrile,3-cyanonitrobenzene,m-cyanonitrobenzene,benzonitrile, m-nitro,3-cyano-1-nitrobenzene,3-nitro-benzonitrile,ccris 2327,3-nitrobenzenecarbonitrile,3-nitrobenzonitril PubChem CID: 12079 IUPAC Name: 3-nitrobenzonitrile SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C#N

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Specifications

PubChem CID	12079
CAS	619-24-9
Molecular Weight (g/mol)	148.121
MDL Number	MFCD00007194
SMILES	C1=CC(=CC(=C1)[N+](=O)[O-])C#N
Synonym	benzonitrile, 3-nitro,m-nitrobenzonitrile,3-cyanonitrobenzene,m-cyanonitrobenzene,benzonitrile, m-nitro,3-cyano-1-nitrobenzene,3-nitro-benzonitrile,ccris 2327,3-nitrobenzenecarbonitrile,3-nitrobenzonitril
IUPAC Name	3-nitrobenzonitrile
InChI Key	RUSAWEHOGCWOPG-UHFFFAOYSA-N
Molecular Formula	C7H4N2O2

Ethyl 7-nitroindole-2-carboxylate, 95%

CAS: 6960-46-9 Molecular Formula: C11H10N2O4 Molecular Weight (g/mol): 234.211 MDL Number: MFCD00216475 InChI Key: GTZAIVBXGPLYGD-UHFFFAOYSA-N Synonym: ethyl 7-nitroindole-2-carboxylate,7-nitroindole-2-carboxylic acid ethyl ester,1h-indole-2-carboxylic acid, 7-nitro-, ethyl ester,ethyl-7-nitro-1h-indole-2-carboxylate,2-carbethoxy-7-nitroindole,ethyl 7-nitro-2-indolecarboxylate,indole-2-carboxylic acid, 7-nitro-, ethyl ester,1h-indole-2-carboxylicacid, 7-nitro-, ethyl ester PubChem CID: 250407 IUPAC Name: ethyl 7-nitro-1H-indole-2-carboxylate SMILES: CCOC(=O)C1=CC2=C(N1)C(=CC=C2)[N+](=O)[O-]

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Specifications

PubChem CID	250407
CAS	6960-46-9
Molecular Weight (g/mol)	234.211
MDL Number	MFCD00216475
SMILES	CCOC(=O)C1=CC2=C(N1)C(=CC=C2)[N+](=O)[O-]
Synonym	ethyl 7-nitroindole-2-carboxylate,7-nitroindole-2-carboxylic acid ethyl ester,1h-indole-2-carboxylic acid, 7-nitro-, ethyl ester,ethyl-7-nitro-1h-indole-2-carboxylate,2-carbethoxy-7-nitroindole,ethyl 7-nitro-2-indolecarboxylate,indole-2-carboxylic acid, 7-nitro-, ethyl ester,1h-indole-2-carboxylicacid, 7-nitro-, ethyl ester
IUPAC Name	ethyl 7-nitro-1H-indole-2-carboxylate
InChI Key	GTZAIVBXGPLYGD-UHFFFAOYSA-N
Molecular Formula	C11H10N2O4

4-Nitrobenzyl chloroformate, 95%

CAS: 4457-32-3 Molecular Formula: C₈H₆ClNO₄ Molecular Weight (g/mol): 215.59 MDL Number: MFCD00007375 InChI Key: MHSGOABISYIYKP-UHFFFAOYSA-N Synonym: 4-nitrobenzyl chloroformate,4-nitrobenzyl carbonochloridate,carbonochloridic acid, 4-nitrophenyl methyl ester,4-nitrobenzyl chlorocarbonate,p-nitrobenzyl chloroformate,4-nitrocarbobenzoxychloride,4-nitrophenyl methyl chloroformate,p-nitrobenzyloxycarbonyl chloride,4-nitrobenzyloxycarbonyl chloride,chloroformic acid p-nitrobenzyl ester PubChem CID: 78205 IUPAC Name: (4-nitrophenyl)methyl carbonochloridate SMILES: C1=CC(=CC=C1COC(=O)Cl)[N+](=O)[O-]

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Specifications

PubChem CID	78205
CAS	4457-32-3
Molecular Weight (g/mol)	215.59
MDL Number	MFCD00007375
SMILES	C1=CC(=CC=C1COC(=O)Cl)[N+](=O)[O-]
Synonym	4-nitrobenzyl chloroformate,4-nitrobenzyl carbonochloridate,carbonochloridic acid, 4-nitrophenyl methyl ester,4-nitrobenzyl chlorocarbonate,p-nitrobenzyl chloroformate,4-nitrocarbobenzoxychloride,4-nitrophenyl methyl chloroformate,p-nitrobenzyloxycarbonyl chloride,4-nitrobenzyloxycarbonyl chloride,chloroformic acid p-nitrobenzyl ester
IUPAC Name	(4-nitrophenyl)methyl carbonochloridate
InChI Key	MHSGOABISYIYKP-UHFFFAOYSA-N
Molecular Formula	C₈H₆ClNO₄

Organic oxoazanium compounds

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