4-methylbenzenesulfonate; methyl(diphenyl)sulfanium

Systemtic Name: 4-methylbenzenesulfonate; methyl(diphenyl)sulfanium Openeye Name: 4-methylbenzenesulfonate; methyl(diphenyl)sulfonium CAS Name: 4-methylbenzenesulfonate; methyl(diphenyl)sulfonium IUPAC Name: 4-methylbenzenesulfonate; methyl(diphenyl)sulfanium Traditional Name: methyl(diphenyl)sulfonium tosylate Formula: C20H20O3S2 MolecularWeight: 372.501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[S+](C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[S+](C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C13H13S.C7H8O3S/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;1-6-2-4-7(5-3-6)11(8,9)10/h2-11H,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1