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Details

Stereochemistry ACHIRAL
Molecular Formula C12H9N2O5S.Na
Molecular Weight 316.265
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sodium 2-anilino-5-nitrobenzenesulfonate

SMILES

[Na+].[O-][N+](=O)C1=CC=C(NC2=CC=CC=C2)C(=C1)S([O-])(=O)=O

InChI

InChIKey=OKXKVNPMOSWVPS-UHFFFAOYSA-M
InChI=1S/C12H10N2O5S.Na/c15-14(16)10-6-7-11(12(8-10)20(17,18)19)13-9-4-2-1-3-5-9;/h1-8,13H,(H,17,18,19);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C12H9N2O5S
Molecular Weight 293.275
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
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 12:42:33 GMT 2023
Edited
by admin
on Sat Dec 16 12:42:33 GMT 2023
Record UNII
S2MCP5KDL4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Sodium 2-anilino-5-nitrobenzenesulfonate
Systematic Name English
Benzenesulfonic acid, 5-nitro-2-(phenylamino)-, sodium salt (1:1)
Systematic Name English
Benzenesulfonic acid, 5-nitro-2-(phenylamino)-, sodium salt
Common Name English
Code System Code Type Description
CAS
3809-31-2
Created by admin on Sat Dec 16 12:42:33 GMT 2023 , Edited by admin on Sat Dec 16 12:42:33 GMT 2023
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EPA CompTox
DTXSID50191492
Created by admin on Sat Dec 16 12:42:33 GMT 2023 , Edited by admin on Sat Dec 16 12:42:33 GMT 2023
PRIMARY
FDA UNII
S2MCP5KDL4
Created by admin on Sat Dec 16 12:42:33 GMT 2023 , Edited by admin on Sat Dec 16 12:42:33 GMT 2023
PRIMARY
ECHA (EC/EINECS)
223-280-8
Created by admin on Sat Dec 16 12:42:33 GMT 2023 , Edited by admin on Sat Dec 16 12:42:33 GMT 2023
PRIMARY
PUBCHEM
3014244
Created by admin on Sat Dec 16 12:42:33 GMT 2023 , Edited by admin on Sat Dec 16 12:42:33 GMT 2023
PRIMARY