1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-N-(2-pyridin-2-ylethyl)pyrrolidine-3-carboxamide

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-N-(2-pyridin-2-ylethyl)pyrrolidine-3-carboxamide Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-[2-(2-pyridyl)ethyl]pyrrolidine-3-carboxamide CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-[2-(2-pyridinyl)ethyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-(2-pyridin-2-ylethyl)pyrrolidine-3-carboxamide Traditional Name: 1-homoveratryl-5-keto-N-[2-(2-pyridyl)ethyl]pyrrolidine-3-carboxamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CC(CC2=O)C(=O)NCCC3=CC=CC=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CC(CC2=O)C(=O)NCCC3=CC=CC=N3)OC

InChI

InChI=1S/C22H27N3O4/c1-28-19-7-6-16(13-20(19)29-2)9-12-25-15-17(14-21(25)26)22(27)24-11-8-18-5-3-4-10-23-18/h3-7,10,13,17H,8-9,11-12,14-15H2,1-2H3,(H,24,27)