[2-[4-[(2R)-butan-2-yl]phenyl]-2-oxidanylidene-ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: [2-[4-[(2R)-butan-2-yl]phenyl]-2-oxidanylidene-ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: [2-[4-[(1R)-1-methylpropyl]phenyl]-2-oxo-ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid [2-[4-[(2R)-butan-2-yl]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[(2R)-butan-2-yl]phenyl]-2-oxoethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid [2-keto-2-[4-[(1R)-1-methylpropyl]phenyl]ethyl] ester Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(=O)COC(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C)C1=CC=C(C=C1)C(=O)COC(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C25H30N2O4/c1-3-18(2)19-9-11-20(12-10-19)23(28)17-31-24(29)21-13-15-27(16-14-21)25(30)26-22-7-5-4-6-8-22/h4-12,18,21H,3,13-17H2,1-2H3,(H,26,30)/t18-/m1/s1