2-(3,4-dimethoxyphenyl)-2-propan-2-yl-5-[4-(2,4,6-trimethylphenyl)carbonylpiperidin-1-yl]pentanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-2-propan-2-yl-5-[4-(2,4,6-trimethylphenyl)carbonylpiperidin-1-yl]pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[4-(2,4,6-trimethylbenzoyl)-1-piperidyl]pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-[4-[oxo-(2,4,6-trimethylphenyl)methyl]-1-piperidinyl]-2-propan-2-ylpentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-2-propan-2-yl-5-[4-(2,4,6-trimethylbenzoyl)piperidin-1-yl]pentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[4-(2,4,6-trimethylbenzoyl)piperidino]valeronitrile Formula: C31H42N2O3 MolecularWeight: 490.67678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)C2CCN(CC2)CCCC(C#N)(C3=CC(=C(C=C3)OC)OC)C(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)C2CCN(CC2)CCCC(C#N)(C3=CC(=C(C=C3)OC)OC)C(C)C)C

InChI

InChI=1S/C31H42N2O3/c1-21(2)31(20-32,26-9-10-27(35-6)28(19-26)36-7)13-8-14-33-15-11-25(12-16-33)30(34)29-23(4)17-22(3)18-24(29)5/h9-10,17-19,21,25H,8,11-16H2,1-7H3