2-(3,4-dimethoxyphenyl)-3-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-2-naphthalen-1-yl-pentanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-2-naphthalen-1-yl-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-3-[4-(4-fluorobenzoyl)-1-piperidyl]-2-(1-naphthyl)pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-3-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]-2-(1-naphthalenyl)pentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-3-[4-(4-fluorobenzoyl)piperidin-1-yl]-2-naphthalen-1-ylpentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-3-[4-(4-fluorobenzoyl)piperidino]-2-(1-naphthyl)valeronitrile Formula: C35H35FN2O3 MolecularWeight: 550.662403

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C#N)(C1=CC(=C(C=C1)OC)OC)C2=CC=CC3=CC=CC=C32)N4CCC(CC4)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CCC(C(C#N)(C1=CC(=C(C=C1)OC)OC)C2=CC=CC3=CC=CC=C32)N4CCC(CC4)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C35H35FN2O3/c1-4-33(38-20-18-26(19-21-38)34(39)25-12-15-28(36)16-13-25)35(23-37,27-14-17-31(40-2)32(22-27)41-3)30-11-7-9-24-8-5-6-10-29(24)30/h5-17,22,26,33H,4,18-21H2,1-3H3