ethyl (2S,3R)-2-(3,4-dimethoxyphenyl)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: ethyl (2S,3R)-2-(3,4-dimethoxyphenyl)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate Openeye Name: ethyl (2S,3R)-2-(3,4-dimethoxyphenyl)-5-oxo-1-phenyl-pyrrolidine-3-carboxylate CAS Name: (2S,3R)-2-(3,4-dimethoxyphenyl)-5-oxo-1-phenyl-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R)-2-(3,4-dimethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxylate Traditional Name: (2S,3R)-2-(3,4-dimethoxyphenyl)-5-keto-1-phenyl-pyrrolidine-3-carboxylic acid ethyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(=O)N(C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H]1CC(=O)N([C@@H]1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO5/c1-4-27-21(24)16-13-19(23)22(15-8-6-5-7-9-15)20(16)14-10-11-17(25-2)18(12-14)26-3/h5-12,16,20H,4,13H2,1-3H3/t16-,20-/m1/s1