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

Systemtic Name: [1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: [1-methyl-2-oxo-2-(p-tolyl)ethyl] (2S)-3-methyl-2-(p-tolylsulfonylamino)butanoate CAS Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoic acid [1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylphenyl)-1-oxopropan-2-yl] (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: (2S)-3-methyl-2-(tosylamino)butyric acid [2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C(C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H27NO5S/c1-14(2)20(23-29(26,27)19-12-8-16(4)9-13-19)22(25)28-17(5)21(24)18-10-6-15(3)7-11-18/h6-14,17,20,23H,1-5H3/t17?,20-/m0/s1