2-[(4-chlorophenyl)methyl]-3-methyl-N-(4-methylcyclohexyl)-1-oxidanylidene-4H-isoquinoline-3-carboxamide

Systemtic Name: 2-[(4-chlorophenyl)methyl]-3-methyl-N-(4-methylcyclohexyl)-1-oxidanylidene-4H-isoquinoline-3-carboxamide Openeye Name: 2-[(4-chlorophenyl)methyl]-3-methyl-N-(4-methylcyclohexyl)-1-oxo-4H-isoquinoline-3-carboxamide CAS Name: 2-[(4-chlorophenyl)methyl]-3-methyl-N-(4-methylcyclohexyl)-1-oxo-4H-isoquinoline-3-carboxamide IUPAC Name: 2-[(4-chlorophenyl)methyl]-3-methyl-N-(4-methylcyclohexyl)-1-oxo-4H-isoquinoline-3-carboxamide Traditional Name: 2-(4-chlorobenzyl)-1-keto-3-methyl-N-(4-methylcyclohexyl)-4H-isoquinoline-3-carboxamide Formula: C25H29ClN2O2 MolecularWeight: 424.96296

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)C2(CC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1CCC(CC1)NC(=O)C2(CC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C25H29ClN2O2/c1-17-7-13-21(14-8-17)27-24(30)25(2)15-19-5-3-4-6-22(19)23(29)28(25)16-18-9-11-20(26)12-10-18/h3-6,9-12,17,21H,7-8,13-16H2,1-2H3,(H,27,30)