4-methylbenzenesulfonate; (4-methylphenyl)carbonylsulfanium

Systemtic Name: 4-methylbenzenesulfonate; (4-methylphenyl)carbonylsulfanium Openeye Name: 4-methylbenzenesulfonate; (4-methylbenzoyl)sulfonium CAS Name: 4-methylbenzenesulfonate; [(4-methylphenyl)-oxomethyl]sulfonium IUPAC Name: 4-methylbenzenesulfonate; (4-methylbenzoyl)sulfanium Traditional Name: p-toluoylsulfonium tosylate Formula: C15H16O4S2 MolecularWeight: 324.41514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)[SH2+].CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[SH2+].CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C8H8OS.C7H8O3S/c1-6-2-4-7(5-3-6)8(9)10;1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H,9,10);2-5H,1H3,(H,8,9,10)