(2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl) (2S)-2-benzamido-3-methyl-butanoate

Systemtic Name: (2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl) (2S)-2-benzamido-3-methyl-butanoate Openeye Name: [2-oxo-1-phenyl-2-(1-piperidyl)ethyl] (2S)-2-benzamido-3-methyl-butanoate CAS Name: (2S)-2-benzamido-3-methylbutanoic acid [2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-1-phenyl-2-piperidin-1-ylethyl) (2S)-2-benzamido-3-methylbutanoate Traditional Name: (2S)-2-benzamido-3-methyl-butyric acid (2-keto-1-phenyl-2-piperidino-ethyl) ester Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C1=CC=CC=C1)C(=O)N2CCCCC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)OC(C1=CC=CC=C1)C(=O)N2CCCCC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H30N2O4/c1-18(2)21(26-23(28)20-14-8-4-9-15-20)25(30)31-22(19-12-6-3-7-13-19)24(29)27-16-10-5-11-17-27/h3-4,6-9,12-15,18,21-22H,5,10-11,16-17H2,1-2H3,(H,26,28)/t21-,22?/m0/s1