[1-(3-methoxyphenyl)-2-methyl-2-oxidanyl-3-oxidanylidene-3-phenyl-propyl] 4-methylbenzenesulfonate

Systemtic Name: [1-(3-methoxyphenyl)-2-methyl-2-oxidanyl-3-oxidanylidene-3-phenyl-propyl] 4-methylbenzenesulfonate Openeye Name: [2-hydroxy-1-(3-methoxyphenyl)-2-methyl-3-oxo-3-phenyl-propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-hydroxy-1-(3-methoxyphenyl)-2-methyl-3-oxo-3-phenylpropyl] ester IUPAC Name: [2-hydroxy-1-(3-methoxyphenyl)-2-methyl-3-oxo-3-phenylpropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-hydroxy-3-keto-1-(3-methoxyphenyl)-2-methyl-3-phenyl-propyl] ester Formula: C24H24O6S MolecularWeight: 440.50876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24O6S/c1-17-12-14-21(15-13-17)31(27,28)30-23(19-10-7-11-20(16-19)29-3)24(2,26)22(25)18-8-5-4-6-9-18/h4-16,23,26H,1-3H3