2-(3,4-dimethoxyphenyl)-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]ethanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]ethanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]acetonitrile CAS Name: 2-(3,4-dimethoxyphenyl)-2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]acetonitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-2-[4-(2-keto-2-pyrrolidino-ethyl)piperazino]acetonitrile Formula: C20H28N4O3 MolecularWeight: 372.46132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C#N)N2CCN(CC2)CC(=O)N3CCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C#N)N2CCN(CC2)CC(=O)N3CCCC3)OC

InChI

InChI=1S/C20H28N4O3/c1-26-18-6-5-16(13-19(18)27-2)17(14-21)23-11-9-22(10-12-23)15-20(25)24-7-3-4-8-24/h5-6,13,17H,3-4,7-12,15H2,1-2H3