ethyl 1-[[1-(3,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[1-(3,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[1-(3,4-dimethoxyphenyl)-5-oxo-pyrrolidin-3-yl]carbamoyl]piperidine-4-carboxylate CAS Name: 1-[[[1-(3,4-dimethoxyphenyl)-5-oxo-3-pyrrolidinyl]amino]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[1-(3,4-dimethoxyphenyl)-5-oxopyrrolidin-3-yl]carbamoyl]piperidine-4-carboxylate Traditional Name: 1-[[1-(3,4-dimethoxyphenyl)-5-keto-pyrrolidin-3-yl]carbamoyl]isonipecotic acid ethyl ester Formula: C21H29N3O6 MolecularWeight: 419.47146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)NC2CC(=O)N(C2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)NC2CC(=O)N(C2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H29N3O6/c1-4-30-20(26)14-7-9-23(10-8-14)21(27)22-15-11-19(25)24(13-15)16-5-6-17(28-2)18(12-16)29-3/h5-6,12,14-15H,4,7-11,13H2,1-3H3,(H,22,27)