(1-acetamido-1-oxidanylidene-2-phenyl-propan-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (1-acetamido-1-oxidanylidene-2-phenyl-propan-2-yl) 4-methylbenzenesulfonate Openeye Name: (2-acetamido-1-methyl-2-oxo-1-phenyl-ethyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-acetamido-1-oxo-2-phenylpropan-2-yl) ester IUPAC Name: (1-acetamido-1-oxo-2-phenylpropan-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-acetamido-2-keto-1-methyl-1-phenyl-ethyl) ester Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO5S/c1-13-9-11-16(12-10-13)25(22,23)24-18(3,17(21)19-14(2)20)15-7-5-4-6-8-15/h4-12H,1-3H3,(H,19,20,21)