2-cyclopentyl-2-(3,4-dimethoxyphenyl)-5-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]pentanenitrile

Systemtic Name: 2-cyclopentyl-2-(3,4-dimethoxyphenyl)-5-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]pentanenitrile Openeye Name: 2-cyclopentyl-2-(3,4-dimethoxyphenyl)-5-[4-(4-fluorobenzoyl)-1-piperidyl]pentanenitrile CAS Name: 2-cyclopentyl-2-(3,4-dimethoxyphenyl)-5-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]pentanenitrile IUPAC Name: 2-cyclopentyl-2-(3,4-dimethoxyphenyl)-5-[4-(4-fluorobenzoyl)piperidin-1-yl]pentanenitrile Traditional Name: 2-cyclopentyl-2-(3,4-dimethoxyphenyl)-5-[4-(4-fluorobenzoyl)piperidino]valeronitrile Formula: C30H37FN2O3 MolecularWeight: 492.624783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CCCN2CCC(CC2)C(=O)C3=CC=C(C=C3)F)(C#N)C4CCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CCCN2CCC(CC2)C(=O)C3=CC=C(C=C3)F)(C#N)C4CCCC4)OC

InChI

InChI=1S/C30H37FN2O3/c1-35-27-13-10-25(20-28(27)36-2)30(21-32,24-6-3-4-7-24)16-5-17-33-18-14-23(15-19-33)29(34)22-8-11-26(31)12-9-22/h8-13,20,23-24H,3-7,14-19H2,1-2H3