N-(2-cyanoethyl)-2-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-N-phenyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[2-(2,4-dimethoxyphenyl)pyrrolidino]-N-phenyl-acetamide Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCCN2CC(=O)N(CCC#N)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2CCCN2CC(=O)N(CCC#N)C3=CC=CC=C3)OC

InChI

InChI=1S/C23H27N3O3/c1-28-19-11-12-20(22(16-19)29-2)21-10-6-14-25(21)17-23(27)26(15-7-13-24)18-8-4-3-5-9-18/h3-5,8-9,11-12,16,21H,6-7,10,14-15,17H2,1-2H3