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

Details

Stereochemistry ACHIRAL
Molecular Formula C25H20ClN3O3
Molecular Weight 445.898
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 4-[2-(5-Chloro-2-methylphenyl)diazenyl]-3-hydroxy-N-(2-methoxyphenyl)-2-naphthalenecarboxamide

SMILES

COC1=CC=CC=C1NC(=O)C2=C(O)C(\N=N\C3=CC(Cl)=CC=C3C)=C4C=CC=CC4=C2

InChI

InChIKey=VLENPWQNQFIXCX-ZQHSETAFSA-N
InChI=1S/C25H20ClN3O3/c1-15-11-12-17(26)14-21(15)28-29-23-18-8-4-3-7-16(18)13-19(24(23)30)25(31)27-20-9-5-6-10-22(20)32-2/h3-14,30H,1-2H3,(H,27,31)/b29-28+

HIDE SMILES / InChI

Molecular Formula C25H20ClN3O3
Molecular Weight 445.898
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 Tue Apr 01 19:29:58 GMT 2025
Edited
by admin
on Tue Apr 01 19:29:58 GMT 2025
Record UNII
XAS797CP2P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-[2-(5-Chloro-2-methylphenyl)diazenyl]-3-hydroxy-N-(2-methoxyphenyl)-2-naphthalenecarboxamide
Systematic Name English
2-Naphthalenecarboxamide, 4-[(5-chloro-2-methylphenyl)azo]-3-hydroxy-N-(2-methoxyphenyl)-
Preferred Name English
2-Naphthalenecarboxamide, 4-[2-(5-chloro-2-methylphenyl)diazenyl]-3-hydroxy-N-(2-methoxyphenyl)-
Systematic Name English
2-Naphth-o-anisidide, 4-[(5-chloro-o-tolyl)azo]-3-hydroxy-
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
244-636-9
Created by admin on Tue Apr 01 19:29:58 GMT 2025 , Edited by admin on Tue Apr 01 19:29:58 GMT 2025
PRIMARY
FDA UNII
XAS797CP2P
Created by admin on Tue Apr 01 19:29:58 GMT 2025 , Edited by admin on Tue Apr 01 19:29:58 GMT 2025
PRIMARY
EPA CompTox
DTXSID6066739
Created by admin on Tue Apr 01 19:29:58 GMT 2025 , Edited by admin on Tue Apr 01 19:29:58 GMT 2025
PRIMARY
CAS
21889-28-1
Created by admin on Tue Apr 01 19:29:58 GMT 2025 , Edited by admin on Tue Apr 01 19:29:58 GMT 2025
PRIMARY