[1-(4-methylphenyl)-1-oxidanylidene-3-phenyl-propan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [1-(4-methylphenyl)-1-oxidanylidene-3-phenyl-propan-2-yl] 4-methylbenzenesulfonate Openeye Name: [1-benzyl-2-oxo-2-(p-tolyl)ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(4-methylphenyl)-1-oxo-3-phenylpropan-2-yl] ester IUPAC Name: [1-(4-methylphenyl)-1-oxo-3-phenylpropan-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [1-benzyl-2-keto-2-(p-tolyl)ethyl] ester Formula: C23H22O4S MolecularWeight: 394.48338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(CC2=CC=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(CC2=CC=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H22O4S/c1-17-8-12-20(13-9-17)23(24)22(16-19-6-4-3-5-7-19)27-28(25,26)21-14-10-18(2)11-15-21/h3-15,22H,16H2,1-2H3