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

Systemtic Name: 2-[(2-chlorophenyl)methyl]-N-cyclooctyl-3-methyl-1-oxidanylidene-4H-isoquinoline-3-carboxamide Openeye Name: 2-[(2-chlorophenyl)methyl]-N-cyclooctyl-3-methyl-1-oxo-4H-isoquinoline-3-carboxamide CAS Name: 2-[(2-chlorophenyl)methyl]-N-cyclooctyl-3-methyl-1-oxo-4H-isoquinoline-3-carboxamide IUPAC Name: 2-[(2-chlorophenyl)methyl]-N-cyclooctyl-3-methyl-1-oxo-4H-isoquinoline-3-carboxamide Traditional Name: 2-(2-chlorobenzyl)-N-cyclooctyl-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)N1CC3=CC=CC=C3Cl)C(=O)NC4CCCCCCC4

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3Cl)C(=O)NC4CCCCCCC4

InChI

InChI=1S/C26H31ClN2O2/c1-26(25(31)28-21-13-5-3-2-4-6-14-21)17-19-11-7-9-15-22(19)24(30)29(26)18-20-12-8-10-16-23(20)27/h7-12,15-16,21H,2-6,13-14,17-18H2,1H3,(H,28,31)