ethyl 1-[1-(5-oxidanylidene-1-phenyl-pyrrolidin-3-yl)carbonylpiperidin-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(5-oxidanylidene-1-phenyl-pyrrolidin-3-yl)carbonylpiperidin-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-(5-oxo-1-phenyl-pyrrolidine-3-carbonyl)piperidine-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[oxo-[1-[oxo-(5-oxo-1-phenyl-3-pyrrolidinyl)methyl]-4-piperidinyl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(5-oxo-1-phenylpyrrolidine-3-carbonyl)piperidine-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-(5-keto-1-phenyl-pyrrolidine-3-carbonyl)isonipecotoyl]nipecotic acid ethyl ester Formula: C25H33N3O5 MolecularWeight: 455.54662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)C(=O)C3CC(=O)N(C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)C(=O)C3CC(=O)N(C3)C4=CC=CC=C4

InChI

InChI=1S/C25H33N3O5/c1-2-33-25(32)19-7-6-12-27(16-19)23(30)18-10-13-26(14-11-18)24(31)20-15-22(29)28(17-20)21-8-4-3-5-9-21/h3-5,8-9,18-20H,2,6-7,10-17H2,1H3