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Details

Stereochemistry ACHIRAL
Molecular Formula C12H11N3O5S
Molecular Weight 309.298
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Aniline Nitro Nerol Acid

SMILES

NC1=CC=C(NC2=CC=C(C=C2S(O)(=O)=O)[N+]([O-])=O)C=C1

InChI

InChIKey=GSITZZUEHIPPMH-UHFFFAOYSA-N
InChI=1S/C12H11N3O5S/c13-8-1-3-9(4-2-8)14-11-6-5-10(15(16)17)7-12(11)21(18,19)20/h1-7,14H,13H2,(H,18,19,20)

HIDE SMILES / InChI

Molecular Formula C12H11N3O5S
Molecular Weight 309.298
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:22:25 GMT 2023
Edited
by admin
on Sat Dec 16 12:22:25 GMT 2023
Record UNII
F9C9UR6E7L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Aniline Nitro Nerol Acid
Common Name English
2-[(4-Aminophenyl)amino]-5-nitrobenzenesulfonic acid
Systematic Name English
Benzenesulphonic acid, 2-(p-aminoanilino)-5-nitro-
Systematic Name English
Benzenesulphonic acid, 2-((4-aminophenyl)amino)-5-nitro-
Systematic Name English
2-(4-Aminoanilino)-5-nitrobenzenesulfonic acid
Systematic Name English
Benzenesulfonic acid, 2-((4-aminophenyl)amino)-5-nitro-
Systematic Name English
NSC-5534
Code English
Benzenesulfonic acid, 2-(p-aminoanilino)-5-nitro-
Systematic Name English
2-(p-Aminoanilino)-5-nitrobenzenesulphonic acid
Systematic Name English
2-[(4-Aminophenyl)amino]-5-nitrobenzenesulphonic acid
Systematic Name English
2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid
Systematic Name English
2-(p-Aminoanilino)-5-nitrobenzenesulfonic acid
Systematic Name English
Code System Code Type Description
NSC
5534
Created by admin on Sat Dec 16 12:22:25 GMT 2023 , Edited by admin on Sat Dec 16 12:22:25 GMT 2023
PRIMARY
CAS
91-29-2
Created by admin on Sat Dec 16 12:22:25 GMT 2023 , Edited by admin on Sat Dec 16 12:22:25 GMT 2023
PRIMARY
PUBCHEM
3265240
Created by admin on Sat Dec 16 12:22:25 GMT 2023 , Edited by admin on Sat Dec 16 12:22:25 GMT 2023
PRIMARY
FDA UNII
F9C9UR6E7L
Created by admin on Sat Dec 16 12:22:25 GMT 2023 , Edited by admin on Sat Dec 16 12:22:25 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-057-9
Created by admin on Sat Dec 16 12:22:25 GMT 2023 , Edited by admin on Sat Dec 16 12:22:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID1059020
Created by admin on Sat Dec 16 12:22:25 GMT 2023 , Edited by admin on Sat Dec 16 12:22:25 GMT 2023
PRIMARY