methyl 4-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[(1-homoveratryl-5-keto-pyrrolidine-3-carbonyl)amino]benzoic acid methyl ester Formula: C23H26N2O6 MolecularWeight: 426.46234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CC(CC2=O)C(=O)NC3=CC=C(C=C3)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CC(CC2=O)C(=O)NC3=CC=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C23H26N2O6/c1-29-19-9-4-15(12-20(19)30-2)10-11-25-14-17(13-21(25)26)22(27)24-18-7-5-16(6-8-18)23(28)31-3/h4-9,12,17H,10-11,13-14H2,1-3H3,(H,24,27)