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

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-2-methyl-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-5-[4-(4-fluorobenzoyl)-1-piperidyl]-2-methyl-pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]-2-methylpentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[4-(4-fluorobenzoyl)piperidin-1-yl]-2-methylpentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-5-[4-(4-fluorobenzoyl)piperidino]-2-methyl-valeronitrile Formula: C26H31FN2O3 MolecularWeight: 438.534343

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCN1CCC(CC1)C(=O)C2=CC=C(C=C2)F)(C#N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(CCCN1CCC(CC1)C(=O)C2=CC=C(C=C2)F)(C#N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C26H31FN2O3/c1-26(18-28,21-7-10-23(31-2)24(17-21)32-3)13-4-14-29-15-11-20(12-16-29)25(30)19-5-8-22(27)9-6-19/h5-10,17,20H,4,11-16H2,1-3H3