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

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-[4-(2,3-dimethoxyphenyl)carbonylpiperidin-1-yl]-2-propan-2-yl-pentanenitrile Openeye Name: 5-[4-(2,3-dimethoxybenzoyl)-1-piperidyl]-2-(3,4-dimethoxyphenyl)-2-isopropyl-pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-[4-[(2,3-dimethoxyphenyl)-oxomethyl]-1-piperidinyl]-2-propan-2-ylpentanenitrile IUPAC Name: 5-[4-(2,3-dimethoxybenzoyl)piperidin-1-yl]-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-(4-o-veratroylpiperidino)valeronitrile Formula: C30H40N2O5 MolecularWeight: 508.649

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H40N2O5/c1-21(2)30(20-31,23-11-12-25(34-3)27(19-23)36-5)15-8-16-32-17-13-22(14-18-32)28(33)24-9-7-10-26(35-4)29(24)37-6/h7,9-12,19,21-22H,8,13-18H2,1-6H3