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Details

Stereochemistry ACHIRAL
Molecular Formula C23H18O7S2
Molecular Weight 470.515
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-[[2-Hydroxy-5-[(4-hydroxyphenyl)sulfonyl]phenyl]methyl]-2-naphthalenesulfonic acid

SMILES

OC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(O)C(CC3=CC4=C(C=C3)C=CC(=C4)S(O)(=O)=O)=C2

InChI

InChIKey=PZNUDBAENICMJW-UHFFFAOYSA-N
InChI=1S/C23H18O7S2/c24-19-4-7-20(8-5-19)31(26,27)21-9-10-23(25)18(14-21)12-15-1-2-16-3-6-22(32(28,29)30)13-17(16)11-15/h1-11,13-14,24-25H,12H2,(H,28,29,30)

HIDE SMILES / InChI

Molecular Formula C23H18O7S2
Molecular Weight 470.515
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 18:52:55 GMT 2025
Edited
by admin
on Tue Apr 01 18:52:55 GMT 2025
Record UNII
H3NM4EFJ3C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Naphthalenesulfonic acid, 7-[[2-hydroxy-5-[(4-hydroxyphenyl)sulfonyl]phenyl]methyl]-
Preferred Name English
7-[[2-Hydroxy-5-[(4-hydroxyphenyl)sulfonyl]phenyl]methyl]-2-naphthalenesulfonic acid
Systematic Name English
Code System Code Type Description
CAS
66214-40-2
Created by admin on Tue Apr 01 18:52:55 GMT 2025 , Edited by admin on Tue Apr 01 18:52:55 GMT 2025
PRIMARY
PUBCHEM
105325
Created by admin on Tue Apr 01 18:52:55 GMT 2025 , Edited by admin on Tue Apr 01 18:52:55 GMT 2025
PRIMARY
FDA UNII
H3NM4EFJ3C
Created by admin on Tue Apr 01 18:52:55 GMT 2025 , Edited by admin on Tue Apr 01 18:52:55 GMT 2025
PRIMARY
EPA CompTox
DTXSID1070432
Created by admin on Tue Apr 01 18:52:55 GMT 2025 , Edited by admin on Tue Apr 01 18:52:55 GMT 2025
PRIMARY
ECHA (EC/EINECS)
266-241-0
Created by admin on Tue Apr 01 18:52:55 GMT 2025 , Edited by admin on Tue Apr 01 18:52:55 GMT 2025
PRIMARY