1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]pyrrolidine-3-carboxamide Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]pyrrolidine-3-carboxamide CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]pyrrolidine-3-carboxamide Traditional Name: 1-homoveratryl-5-keto-N-[(6-pyrrolidino-3-pyridyl)methyl]pyrrolidine-3-carboxamide Formula: C25H32N4O4 MolecularWeight: 452.54598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CC(CC2=O)C(=O)NCC3=CN=C(C=C3)N4CCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CC(CC2=O)C(=O)NCC3=CN=C(C=C3)N4CCCC4)OC

InChI

InChI=1S/C25H32N4O4/c1-32-21-7-5-18(13-22(21)33-2)9-12-29-17-20(14-24(29)30)25(31)27-16-19-6-8-23(26-15-19)28-10-3-4-11-28/h5-8,13,15,20H,3-4,9-12,14,16-17H2,1-2H3,(H,27,31)