U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C19H17N3O9S2
Molecular Weight 495.483
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ACID VIOLET 12 FREE ACID

SMILES

COC1=CC=CC=C1\N=N\C2=C(C=C3C=C(C=C(NC(C)=O)C3=C2O)S(O)(=O)=O)S(O)(=O)=O

InChI

InChIKey=GWWYFEYLWLUZFT-QURGRASLSA-N
InChI=1S/C19H17N3O9S2/c1-10(23)20-14-9-12(32(25,26)27)7-11-8-16(33(28,29)30)18(19(24)17(11)14)22-21-13-5-3-4-6-15(13)31-2/h3-9,24H,1-2H3,(H,20,23)(H,25,26,27)(H,28,29,30)/b22-21+

HIDE SMILES / InChI

Molecular Formula C19H17N3O9S2
Molecular Weight 495.483
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:07:29 GMT 2023
Edited
by admin
on Sat Dec 16 08:07:29 GMT 2023
Record UNII
CAK24J797I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACID VIOLET 12 FREE ACID
Common Name English
2,7-NAPHTHALENEDISULFONIC ACID, 5-(ACETYLAMINO)-4-HYDROXY-3-((2-METHOXYPHENYL)AZO)-
Common Name English
2,7-NAPHTHALENEDISULFONIC ACID, 5-(ACETYLAMINO)-4-HYDROXY-3-(2-(2-METHOXYPHENYL)DIAZENYL)-
Systematic Name English
C.I. ACID VIOLET 12, PARENT
Common Name English
Code System Code Type Description
PUBCHEM
6912863
Created by admin on Sat Dec 16 08:07:30 GMT 2023 , Edited by admin on Sat Dec 16 08:07:30 GMT 2023
PRIMARY
FDA UNII
CAK24J797I
Created by admin on Sat Dec 16 08:07:30 GMT 2023 , Edited by admin on Sat Dec 16 08:07:30 GMT 2023
PRIMARY
CAS
761337-02-4
Created by admin on Sat Dec 16 08:07:30 GMT 2023 , Edited by admin on Sat Dec 16 08:07:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID5048003
Created by admin on Sat Dec 16 08:07:30 GMT 2023 , Edited by admin on Sat Dec 16 08:07:30 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT