(2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl) (2S)-2-[(2-chlorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl) (2S)-2-[(2-chlorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-oxo-1-phenyl-2-(1-piperidyl)ethyl] (2S)-2-[(2-chlorobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2-chlorophenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-1-phenyl-2-piperidin-1-ylethyl) (2S)-2-[(2-chlorobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(2-chlorobenzoyl)amino]-3-methyl-butyric acid (2-keto-1-phenyl-2-piperidino-ethyl) ester Formula: C25H29ClN2O4 MolecularWeight: 456.96176

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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=C3Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)OC(C1=CC=CC=C1)C(=O)N2CCCCC2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C25H29ClN2O4/c1-17(2)21(27-23(29)19-13-7-8-14-20(19)26)25(31)32-22(18-11-5-3-6-12-18)24(30)28-15-9-4-10-16-28/h3,5-8,11-14,17,21-22H,4,9-10,15-16H2,1-2H3,(H,27,29)/t21-,22?/m0/s1