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

Systemtic Name: 2-[2-(4-chlorophenyl)ethyl]-N-cycloheptyl-3-methyl-1-oxidanylidene-4H-isoquinoline-3-carboxamide Openeye Name: 2-[2-(4-chlorophenyl)ethyl]-N-cycloheptyl-3-methyl-1-oxo-4H-isoquinoline-3-carboxamide CAS Name: 2-[2-(4-chlorophenyl)ethyl]-N-cycloheptyl-3-methyl-1-oxo-4H-isoquinoline-3-carboxamide IUPAC Name: 2-[2-(4-chlorophenyl)ethyl]-N-cycloheptyl-3-methyl-1-oxo-4H-isoquinoline-3-carboxamide Traditional Name: 2-[2-(4-chlorophenyl)ethyl]-N-cycloheptyl-1-keto-3-methyl-4H-isoquinoline-3-carboxamide Formula: C26H31ClN2O2 MolecularWeight: 438.98954

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)N1CCC3=CC=C(C=C3)Cl)C(=O)NC4CCCCCC4

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=O)N1CCC3=CC=C(C=C3)Cl)C(=O)NC4CCCCCC4

InChI

InChI=1S/C26H31ClN2O2/c1-26(25(31)28-22-9-4-2-3-5-10-22)18-20-8-6-7-11-23(20)24(30)29(26)17-16-19-12-14-21(27)15-13-19/h6-8,11-15,22H,2-5,9-10,16-18H2,1H3,(H,28,31)