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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H12N2O
Molecular Weight 260.29
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-BENZYL-3-CYANO-2-QUINOLONE

SMILES

O=C1N(CC2=CC=CC=C2)C3=C(C=CC=C3)C=C1C#N

InChI

InChIKey=AXXAPWVIXAWFQK-UHFFFAOYSA-N
InChI=1S/C17H12N2O/c18-11-15-10-14-8-4-5-9-16(14)19(17(15)20)12-13-6-2-1-3-7-13/h1-10H,12H2

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-356352
Preferred Name English
1-BENZYL-3-CYANO-2-QUINOLONE
Systematic Name English
1-BENZYL-2-OXO-1,2-DIHYDRO-3-QUINOLINECARBONITRILE
Systematic Name English
3-QUINOLINECARBONITRILE, 1,2-DIHYDRO-2-OXO-1-(PHENYLMETHYL)-
Systematic Name English
1,2-DIHYDRO-2-OXO-1-(PHENYLMETHYL)-3-QUINOLINECARBONITRILE
Systematic Name English
Code System Code Type Description
CAS
78860-04-5
Created by admin on Tue Apr 01 19:40:15 GMT 2025 , Edited by admin on Tue Apr 01 19:40:15 GMT 2025
PRIMARY
EPA CompTox
DTXSID90229344
Created by admin on Tue Apr 01 19:40:15 GMT 2025 , Edited by admin on Tue Apr 01 19:40:15 GMT 2025
PRIMARY
PUBCHEM
337622
Created by admin on Tue Apr 01 19:40:15 GMT 2025 , Edited by admin on Tue Apr 01 19:40:15 GMT 2025
PRIMARY
FDA UNII
8ODI8L8LDQ
Created by admin on Tue Apr 01 19:40:15 GMT 2025 , Edited by admin on Tue Apr 01 19:40:15 GMT 2025
PRIMARY
NSC
356352
Created by admin on Tue Apr 01 19:40:15 GMT 2025 , Edited by admin on Tue Apr 01 19:40:15 GMT 2025
PRIMARY