N-[(4-chlorophenyl)methyl]-6-(5-cyanopent-1-ynyl)-8-fluoranyl-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-6-(5-cyanopent-1-ynyl)-8-fluoranyl-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-6-(5-cyanopent-1-ynyl)-8-fluoro-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-6-(5-cyanopent-1-ynyl)-8-fluoro-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-6-(5-cyanopent-1-ynyl)-8-fluoro-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-6-(5-cyanopent-1-ynyl)-8-fluoro-4-keto-1H-quinoline-3-carboxamide Formula: C23H17ClFN3O2 MolecularWeight: 421.851383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C2=O)C=C(C=C3F)C#CCCCC#N)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C2=O)C=C(C=C3F)C#CCCCC#N)Cl

InChI

InChI=1S/C23H17ClFN3O2/c24-17-8-6-15(7-9-17)13-28-23(30)19-14-27-21-18(22(19)29)11-16(12-20(21)25)5-3-1-2-4-10-26/h6-9,11-12,14H,1-2,4,13H2,(H,27,29)(H,28,30)