N-[(4-chlorophenyl)methyl]-8-fluoranyl-6-(3-methyl-3-oxidanyl-butyl)-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-8-fluoranyl-6-(3-methyl-3-oxidanyl-butyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-8-fluoro-6-(3-hydroxy-3-methyl-butyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-8-fluoro-6-(3-hydroxy-3-methylbutyl)-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-8-fluoro-6-(3-hydroxy-3-methylbutyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-8-fluoro-6-(3-hydroxy-3-methyl-butyl)-4-keto-1H-quinoline-3-carboxamide Formula: C22H22ClFN2O3 MolecularWeight: 416.873083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=CC(=C2C(=C1)C(=O)C(=CN2)C(=O)NCC3=CC=C(C=C3)Cl)F)O

Isomeric SMILES

CC(C)(CCC1=CC(=C2C(=C1)C(=O)C(=CN2)C(=O)NCC3=CC=C(C=C3)Cl)F)O

InChI

InChI=1S/C22H22ClFN2O3/c1-22(2,29)8-7-14-9-16-19(18(24)10-14)25-12-17(20(16)27)21(28)26-11-13-3-5-15(23)6-4-13/h3-6,9-10,12,29H,7-8,11H2,1-2H3,(H,25,27)(H,26,28)