[(2S)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(2-phenylanilino)ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid [(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl] 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid [(1S)-2-keto-1-methyl-2-(2-phenylanilino)ethyl] ester Formula: C28H29N3O4 MolecularWeight: 471.54756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)OC(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)OC(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C28H29N3O4/c1-20(26(32)30-25-15-9-8-14-24(25)21-10-4-2-5-11-21)35-27(33)22-16-18-31(19-17-22)28(34)29-23-12-6-3-7-13-23/h2-15,20,22H,16-19H2,1H3,(H,29,34)(H,30,32)/t20-/m0/s1