[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 3-[(4-acetamidophenyl)sulfonylamino]propanoate

Systemtic Name: [(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 3-[(4-acetamidophenyl)sulfonylamino]propanoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(p-tolyl)ethyl] 3-[(4-acetamidophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-acetamidophenyl)sulfonylamino]propanoic acid [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] 3-[(4-acetamidophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-acetamidophenyl)sulfonylamino]propionic acid [(1S)-2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O6S/c1-14-4-6-17(7-5-14)21(26)15(2)29-20(25)12-13-22-30(27,28)19-10-8-18(9-11-19)23-16(3)24/h4-11,15,22H,12-13H2,1-3H3,(H,23,24)/t15-/m0/s1