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

Systemtic Name: [3-(2-methoxyphenyl)-2-methyl-2-oxidanyl-3-oxidanylidene-1-phenyl-propyl] benzenesulfonate Openeye Name: [2-hydroxy-3-(2-methoxyphenyl)-2-methyl-3-oxo-1-phenyl-propyl] benzenesulfonate CAS Name: benzenesulfonic acid [2-hydroxy-3-(2-methoxyphenyl)-2-methyl-3-oxo-1-phenylpropyl] ester IUPAC Name: [2-hydroxy-3-(2-methoxyphenyl)-2-methyl-3-oxo-1-phenylpropyl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-hydroxy-3-keto-3-(2-methoxyphenyl)-2-methyl-1-phenyl-propyl] ester Formula: C23H22O6S MolecularWeight: 426.48218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)OS(=O)(=O)C2=CC=CC=C2)(C(=O)C3=CC=CC=C3OC)O

Isomeric SMILES

CC(C(C1=CC=CC=C1)OS(=O)(=O)C2=CC=CC=C2)(C(=O)C3=CC=CC=C3OC)O

InChI

InChI=1S/C23H22O6S/c1-23(25,21(24)19-15-9-10-16-20(19)28-2)22(17-11-5-3-6-12-17)29-30(26,27)18-13-7-4-8-14-18/h3-16,22,25H,1-2H3