N-[1-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]-4-(4-ethanoylphenyl)benzamide

Systemtic Name: N-[1-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]-4-(4-ethanoylphenyl)benzamide Openeye Name: 4-(4-acetylphenyl)-N-[1-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]benzamide CAS Name: 4-(4-acetylphenyl)-N-[1-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]benzamide IUPAC Name: 4-(4-acetylphenyl)-N-[1-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]benzamide Traditional Name: 4-(4-acetylphenyl)-N-[1-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]benzamide Formula: C33H35N3O2 MolecularWeight: 505.6499

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3(CCCCC3)CCN4CCC5=C(C4)C=CC(=C5)C#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3(CCCCC3)CCN4CCC5=C(C4)C=CC(=C5)C#N

InChI

InChI=1S/C33H35N3O2/c1-24(37)26-7-9-27(10-8-26)28-11-13-29(14-12-28)32(38)35-33(16-3-2-4-17-33)18-20-36-19-15-30-21-25(22-34)5-6-31(30)23-36/h5-14,21H,2-4,15-20,23H2,1H3,(H,35,38)