(1-oxidanyl-2-oxidanylidene-1,2-diphenyl-ethyl) 4-methylbenzenesulfonate

Systemtic Name: (1-oxidanyl-2-oxidanylidene-1,2-diphenyl-ethyl) 4-methylbenzenesulfonate Openeye Name: (1-hydroxy-2-oxo-1,2-diphenyl-ethyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-hydroxy-2-oxo-1,2-diphenylethyl) ester IUPAC Name: (1-hydroxy-2-oxo-1,2-diphenylethyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-hydroxy-2-keto-1,2-diphenyl-ethyl) ester Formula: C21H18O5S MolecularWeight: 382.42962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18O5S/c1-16-12-14-19(15-13-16)27(24,25)26-21(23,18-10-6-3-7-11-18)20(22)17-8-4-2-5-9-17/h2-15,23H,1H3