ethyl 3-[[1-(5-oxidanylidene-1-phenyl-pyrrolidin-3-yl)carbonylpiperidin-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[1-(5-oxidanylidene-1-phenyl-pyrrolidin-3-yl)carbonylpiperidin-4-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[1-(5-oxo-1-phenyl-pyrrolidine-3-carbonyl)piperidine-4-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[1-[oxo-(5-oxo-1-phenyl-3-pyrrolidinyl)methyl]-4-piperidinyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[1-(5-oxo-1-phenylpyrrolidine-3-carbonyl)piperidine-4-carbonyl]amino]benzoate Traditional Name: 3-[[1-(5-keto-1-phenyl-pyrrolidine-3-carbonyl)isonipecotoyl]amino]benzoic acid ethyl ester Formula: C26H29N3O5 MolecularWeight: 463.52556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N3O5/c1-2-34-26(33)19-7-6-8-21(15-19)27-24(31)18-11-13-28(14-12-18)25(32)20-16-23(30)29(17-20)22-9-4-3-5-10-22/h3-10,15,18,20H,2,11-14,16-17H2,1H3,(H,27,31)