N-[(4-chlorophenyl)methyl]-6-(2-methylpentan-2-yl)-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-6-(2-methylpentan-2-yl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-6-(1,1-dimethylbutyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-6-(2-methylpentan-2-yl)-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-6-(2-methylpentan-2-yl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-6-(1,1-dimethylbutyl)-4-keto-1H-quinoline-3-carboxamide Formula: C23H25ClN2O2 MolecularWeight: 396.9098

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C1=CC2=C(C=C1)NC=C(C2=O)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCC(C)(C)C1=CC2=C(C=C1)NC=C(C2=O)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H25ClN2O2/c1-4-11-23(2,3)16-7-10-20-18(12-16)21(27)19(14-25-20)22(28)26-13-15-5-8-17(24)9-6-15/h5-10,12,14H,4,11,13H2,1-3H3,(H,25,27)(H,26,28)