N-[1-[2-(6-cyano-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]cyclohexyl]-2-phenyl-benzamide

Systemtic Name: N-[1-[2-(6-cyano-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]cyclohexyl]-2-phenyl-benzamide Openeye Name: N-[1-[2-(6-cyano-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]cyclohexyl]-2-phenyl-benzamide CAS Name: N-[1-[2-(6-cyano-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]cyclohexyl]-2-phenylbenzamide IUPAC Name: N-[1-[2-(6-cyano-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]cyclohexyl]-2-phenylbenzamide Traditional Name: N-[1-[2-(6-cyano-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]cyclohexyl]-2-phenyl-benzamide Formula: C31H33N3O MolecularWeight: 463.61322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CCC2C3=C(CCN2)C=C(C=C3)C#N)NC(=O)C4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)(CCC2C3=C(CCN2)C=C(C=C3)C#N)NC(=O)C4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C31H33N3O/c32-22-23-13-14-27-25(21-23)16-20-33-29(27)15-19-31(17-7-2-8-18-31)34-30(35)28-12-6-5-11-26(28)24-9-3-1-4-10-24/h1,3-6,9-14,21,29,33H,2,7-8,15-20H2,(H,34,35)