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

Systemtic Name: propyl 4-[[1-(5-oxidanylidene-1-phenyl-pyrrolidin-3-yl)carbonylpiperidin-4-yl]carbonylamino]benzoate Openeye Name: propyl 4-[[1-(5-oxo-1-phenyl-pyrrolidine-3-carbonyl)piperidine-4-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[1-[oxo-(5-oxo-1-phenyl-3-pyrrolidinyl)methyl]-4-piperidinyl]methyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[1-(5-oxo-1-phenylpyrrolidine-3-carbonyl)piperidine-4-carbonyl]amino]benzoate Traditional Name: 4-[[1-(5-keto-1-phenyl-pyrrolidine-3-carbonyl)isonipecotoyl]amino]benzoic acid propyl ester Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31N3O5/c1-2-16-35-27(34)20-8-10-22(11-9-20)28-25(32)19-12-14-29(15-13-19)26(33)21-17-24(31)30(18-21)23-6-4-3-5-7-23/h3-11,19,21H,2,12-18H2,1H3,(H,28,32)