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

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) (2S)-2-[(2-chlorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-oxo-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-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) (2S)-2-[(2-chlorobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(2-chlorobenzoyl)amino]-3-methyl-butyric acid (2-keto-2-piperidino-ethyl) ester Formula: C19H25ClN2O4 MolecularWeight: 380.8658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)N1CCCCC1)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)N1CCCCC1)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C19H25ClN2O4/c1-13(2)17(21-18(24)14-8-4-5-9-15(14)20)19(25)26-12-16(23)22-10-6-3-7-11-22/h4-5,8-9,13,17H,3,6-7,10-12H2,1-2H3,(H,21,24)/t17-/m0/s1