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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)N1CCC3=CC=C(C=C3)Cl)C(=O)NC4CCCCC4

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=O)N1CCC3=CC=C(C=C3)Cl)C(=O)NC4CCCCC4

InChI

InChI=1S/C25H29ClN2O2/c1-25(24(30)27-21-8-3-2-4-9-21)17-19-7-5-6-10-22(19)23(29)28(25)16-15-18-11-13-20(26)14-12-18/h5-7,10-14,21H,2-4,8-9,15-17H2,1H3,(H,27,30)