[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 1-(5-aminocarbonylpyridin-2-yl)piperidine-4-carboxylate

Systemtic Name: [2-[(4-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 1-(5-aminocarbonylpyridin-2-yl)piperidine-4-carboxylate Openeye Name: [2-(4-methoxyanilino)-2-oxo-1-phenyl-ethyl] 1-(5-carbamoyl-2-pyridyl)piperidine-4-carboxylate CAS Name: 1-(5-carbamoyl-2-pyridinyl)-4-piperidinecarboxylic acid [2-(4-methoxyanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-methoxyanilino)-2-oxo-1-phenylethyl] 1-(5-carbamoylpyridin-2-yl)piperidine-4-carboxylate Traditional Name: 1-(5-carbamoyl-2-pyridyl)isonipecotic acid [2-keto-2-(p-anisidino)-1-phenyl-ethyl] ester Formula: C27H28N4O5 MolecularWeight: 488.53502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3CCN(CC3)C4=NC=C(C=C4)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3CCN(CC3)C4=NC=C(C=C4)C(=O)N

InChI

InChI=1S/C27H28N4O5/c1-35-22-10-8-21(9-11-22)30-26(33)24(18-5-3-2-4-6-18)36-27(34)19-13-15-31(16-14-19)23-12-7-20(17-29-23)25(28)32/h2-12,17,19,24H,13-16H2,1H3,(H2,28,32)(H,30,33)