2-(3,4-dimethoxyphenyl)-7-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-2-propan-2-yl-heptanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-7-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-2-propan-2-yl-heptanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-7-[4-(4-fluorobenzoyl)-1-piperidyl]-2-isopropyl-heptanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-7-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]-2-propan-2-ylheptanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-7-[4-(4-fluorobenzoyl)piperidin-1-yl]-2-propan-2-ylheptanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-7-[4-(4-fluorobenzoyl)piperidino]-2-isopropyl-enanthonitrile Formula: C30H39FN2O3 MolecularWeight: 494.640663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCCCN1CCC(CC1)C(=O)C2=CC=C(C=C2)F)(C#N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C(CCCCCN1CCC(CC1)C(=O)C2=CC=C(C=C2)F)(C#N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C30H39FN2O3/c1-22(2)30(21-32,25-10-13-27(35-3)28(20-25)36-4)16-6-5-7-17-33-18-14-24(15-19-33)29(34)23-8-11-26(31)12-9-23/h8-13,20,22,24H,5-7,14-19H2,1-4H3