N-[(4-chlorophenyl)methyl]-7-(4-oxidanylbutyl)-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-7-(4-oxidanylbutyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-7-(4-hydroxybutyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-7-(4-hydroxybutyl)-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-7-(4-hydroxybutyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-7-(4-hydroxybutyl)-4-keto-1H-quinoline-3-carboxamide Formula: C21H21ClN2O3 MolecularWeight: 384.85604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C2=O)C=CC(=C3)CCCCO)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C2=O)C=CC(=C3)CCCCO)Cl

InChI

InChI=1S/C21H21ClN2O3/c22-16-7-4-15(5-8-16)12-24-21(27)18-13-23-19-11-14(3-1-2-10-25)6-9-17(19)20(18)26/h4-9,11,13,25H,1-3,10,12H2,(H,23,26)(H,24,27)