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Details

Stereochemistry ACHIRAL
Molecular Formula C18H16N6O6S2
Molecular Weight 476.486
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 4,4?-[(4,6-Diamino-1,3-phenylene)bis(azo)]dibenzenesulfonic acid

SMILES

NC1=CC(N)=C(C=C1\N=N\C2=CC=C(C=C2)S(O)(=O)=O)\N=N\C3=CC=C(C=C3)S(O)(=O)=O

InChI

InChIKey=GWLYOHIRRYBWCA-MBALSZOMSA-N
InChI=1S/C18H16N6O6S2/c19-15-9-16(20)18(24-22-12-3-7-14(8-4-12)32(28,29)30)10-17(15)23-21-11-1-5-13(6-2-11)31(25,26)27/h1-10H,19-20H2,(H,25,26,27)(H,28,29,30)/b23-21+,24-22+

HIDE SMILES / InChI

Molecular Formula C18H16N6O6S2
Molecular Weight 476.486
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:55:39 GMT 2025
Edited
by admin
on Wed Apr 02 17:55:39 GMT 2025
Record UNII
5Z8S45KY83
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzenesulfonic acid, 4,4?-[(4,6-diamino-1,3-phenylene)bis(azo)]bis-
Preferred Name English
4,4?-[(4,6-Diamino-1,3-phenylene)bis(azo)]dibenzenesulfonic acid
Systematic Name English
Code System Code Type Description
CAS
17895-42-0
Created by admin on Wed Apr 02 17:55:39 GMT 2025 , Edited by admin on Wed Apr 02 17:55:39 GMT 2025
PRIMARY
EPA CompTox
DTXSID30864137
Created by admin on Wed Apr 02 17:55:39 GMT 2025 , Edited by admin on Wed Apr 02 17:55:39 GMT 2025
PRIMARY
FDA UNII
5Z8S45KY83
Created by admin on Wed Apr 02 17:55:39 GMT 2025 , Edited by admin on Wed Apr 02 17:55:39 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT