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Details

Stereochemistry ACHIRAL
Molecular Formula C18H17NO4S
Molecular Weight 343.397
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(2,6-Dimethylanilino)-8-hydroxy-6-naphthalenesulfonic acid

SMILES

CC1=CC=CC(C)=C1NC2=CC3=C(C=C2)C=C(C=C3O)S(O)(=O)=O

InChI

InChIKey=GYBJEFAGISHFTI-UHFFFAOYSA-N
InChI=1S/C18H17NO4S/c1-11-4-3-5-12(2)18(11)19-14-7-6-13-8-15(24(21,22)23)10-17(20)16(13)9-14/h3-10,19-20H,1-2H3,(H,21,22,23)

HIDE SMILES / InChI

Molecular Formula C18H17NO4S
Molecular Weight 343.397
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 Tue Apr 01 19:21:51 GMT 2025
Edited
by admin
on Tue Apr 01 19:21:51 GMT 2025
Record UNII
8K6QBG339U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Naphthalenesulfonic acid, 6-[(2,6-dimethylphenyl)amino]-4-hydroxy-
Preferred Name English
2-(2,6-Dimethylanilino)-8-hydroxy-6-naphthalenesulfonic acid
Systematic Name English
2-Naphthalenesulfonic acid, 4-hydroxy-6-(2,6-xylidino)-
Systematic Name English
6-[(2,6-Dimethylphenyl)amino]-4-hydroxy-2-naphthalenesulfonic acid
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID6066945
Created by admin on Tue Apr 01 19:21:51 GMT 2025 , Edited by admin on Tue Apr 01 19:21:51 GMT 2025
PRIMARY
ECHA (EC/EINECS)
245-960-3
Created by admin on Tue Apr 01 19:21:51 GMT 2025 , Edited by admin on Tue Apr 01 19:21:51 GMT 2025
PRIMARY
CAS
23973-67-3
Created by admin on Tue Apr 01 19:21:51 GMT 2025 , Edited by admin on Tue Apr 01 19:21:51 GMT 2025
PRIMARY
PUBCHEM
90320
Created by admin on Tue Apr 01 19:21:51 GMT 2025 , Edited by admin on Tue Apr 01 19:21:51 GMT 2025
PRIMARY
FDA UNII
8K6QBG339U
Created by admin on Tue Apr 01 19:21:51 GMT 2025 , Edited by admin on Tue Apr 01 19:21:51 GMT 2025
PRIMARY