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

Details

Stereochemistry RACEMIC
Molecular Formula C16H11ClNO3.H4N
Molecular Weight 318.755
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENOXAPROFEN AMMONIUM

SMILES

[NH4+].CC(C([O-])=O)C1=CC2=C(OC(=N2)C3=CC=C(Cl)C=C3)C=C1

InChI

InChIKey=DNGLOBZMXKFACM-UHFFFAOYSA-N
InChI=1S/C16H12ClNO3.H3N/c1-9(16(19)20)11-4-7-14-13(8-11)18-15(21-14)10-2-5-12(17)6-3-10;/h2-9H,1H3,(H,19,20);1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
BENOXAPROFEN AMMONIUM
Common Name English
5-BENZOXAZOLEACETIC ACID, 2-(4-CHLOROPHENYL)-.ALPHA.-METHYL-, AMMONIUM SALT (1:1)
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
274-298-8
Created by admin on Sat Dec 16 10:24:30 UTC 2023 , Edited by admin on Sat Dec 16 10:24:30 UTC 2023
PRIMARY
PUBCHEM
3017983
Created by admin on Sat Dec 16 10:24:30 UTC 2023 , Edited by admin on Sat Dec 16 10:24:30 UTC 2023
PRIMARY
EPA CompTox
DTXSID30990304
Created by admin on Sat Dec 16 10:24:30 UTC 2023 , Edited by admin on Sat Dec 16 10:24:30 UTC 2023
PRIMARY
FDA UNII
825YBQ31XF
Created by admin on Sat Dec 16 10:24:30 UTC 2023 , Edited by admin on Sat Dec 16 10:24:30 UTC 2023
PRIMARY
CAS
70062-36-1
Created by admin on Sat Dec 16 10:24:30 UTC 2023 , Edited by admin on Sat Dec 16 10:24:30 UTC 2023
PRIMARY