[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl] (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl] (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: [(1R)-1-methyl-2-oxo-2-(1-piperidyl)ethyl] (2S)-3-methyl-2-(p-tolylsulfonylamino)butanoate CAS Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoic acid [(2R)-1-oxo-1-(1-piperidinyl)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl] (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: (2S)-3-methyl-2-(tosylamino)butyric acid [(1R)-2-keto-1-methyl-2-piperidino-ethyl] ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OC(C)C(=O)N2CCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)O[C@H](C)C(=O)N2CCCCC2

InChI

InChI=1S/C20H30N2O5S/c1-14(2)18(21-28(25,26)17-10-8-15(3)9-11-17)20(24)27-16(4)19(23)22-12-6-5-7-13-22/h8-11,14,16,18,21H,5-7,12-13H2,1-4H3/t16-,18+/m1/s1