[2-methyl-2-[3-(phenylcarbonyl)phenyl]propyl] 4-methylbenzenesulfonate

Systemtic Name: [2-methyl-2-[3-(phenylcarbonyl)phenyl]propyl] 4-methylbenzenesulfonate Openeye Name: [2-(3-benzoylphenyl)-2-methyl-propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(3-benzoylphenyl)-2-methylpropyl] ester IUPAC Name: [2-(3-benzoylphenyl)-2-methylpropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(3-benzoylphenyl)-2-methyl-propyl] ester Formula: C24H24O4S MolecularWeight: 408.50996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)(C)C2=CC=CC(=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)(C)C2=CC=CC(=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H24O4S/c1-18-12-14-22(15-13-18)29(26,27)28-17-24(2,3)21-11-7-10-20(16-21)23(25)19-8-5-4-6-9-19/h4-16H,17H2,1-3H3