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

Systemtic Name: methyl 1-[[1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[[1-(3,4-dimethylphenyl)-5-oxo-pyrrolidin-3-yl]carbamoyl]piperidine-4-carboxylate CAS Name: 1-[[[1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinyl]amino]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]carbamoyl]piperidine-4-carboxylate Traditional Name: 1-[[1-(3,4-dimethylphenyl)-5-keto-pyrrolidin-3-yl]carbamoyl]isonipecotic acid methyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)NC(=O)N3CCC(CC3)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(CC2=O)NC(=O)N3CCC(CC3)C(=O)OC)C

InChI

InChI=1S/C20H27N3O4/c1-13-4-5-17(10-14(13)2)23-12-16(11-18(23)24)21-20(26)22-8-6-15(7-9-22)19(25)27-3/h4-5,10,15-16H,6-9,11-12H2,1-3H3,(H,21,26)