2-cyclopropyl-2-(3,4-dimethoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]pentanenitrile

Systemtic Name: 2-cyclopropyl-2-(3,4-dimethoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]pentanenitrile Openeye Name: 2-cyclopropyl-2-(3,4-dimethoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]pentanenitrile CAS Name: 2-cyclopropyl-2-(3,4-dimethoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl-methylamino]pentanenitrile IUPAC Name: 2-cyclopropyl-2-(3,4-dimethoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl-methylamino]pentanenitrile Traditional Name: 2-cyclopropyl-2-(3,4-dimethoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]valeronitrile Formula: C26H34N2O3 MolecularWeight: 422.55976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(C#N)(C1CC1)C2=CC(=C(C=C2)OC)OC)CCC3=CC(=CC=C3)OC

Isomeric SMILES

CN(CCCC(C#N)(C1CC1)C2=CC(=C(C=C2)OC)OC)CCC3=CC(=CC=C3)OC

InChI

InChI=1S/C26H34N2O3/c1-28(16-13-20-7-5-8-23(17-20)29-2)15-6-14-26(19-27,21-9-10-21)22-11-12-24(30-3)25(18-22)31-4/h5,7-8,11-12,17-18,21H,6,9-10,13-16H2,1-4H3