ethyl 1-[5-oxidanylidene-1-(1-phenylethyl)pyrrolidin-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[5-oxidanylidene-1-(1-phenylethyl)pyrrolidin-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]piperidine-3-carboxylate CAS Name: 1-[oxo-[5-oxo-1-(1-phenylethyl)-3-pyrrolidinyl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[5-keto-1-(1-phenylethyl)pyrrolidine-3-carbonyl]nipecotic acid ethyl ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CC(=O)N(C2)C(C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CC(=O)N(C2)C(C)C3=CC=CC=C3

InChI

InChI=1S/C21H28N2O4/c1-3-27-21(26)17-10-7-11-22(13-17)20(25)18-12-19(24)23(14-18)15(2)16-8-5-4-6-9-16/h4-6,8-9,15,17-18H,3,7,10-14H2,1-2H3