[4-(1-oxidanyl-2-oxidanylidene-ethyl)phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-(1-oxidanyl-2-oxidanylidene-ethyl)phenyl] 4-methylbenzenesulfonate Openeye Name: [4-(1-hydroxy-2-oxo-ethyl)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-(1-hydroxy-2-oxoethyl)phenyl] ester IUPAC Name: [4-(1-hydroxy-2-oxoethyl)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-(1-hydroxy-2-keto-ethyl)phenyl] ester Formula: C15H14O5S MolecularWeight: 306.33366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(C=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(C=O)O

InChI

InChI=1S/C15H14O5S/c1-11-2-8-14(9-3-11)21(18,19)20-13-6-4-12(5-7-13)15(17)10-16/h2-10,15,17H,1H3