4-methylbenzenesulfonate; methyl-(phenylmethyl)sulfanium

Systemtic Name: 4-methylbenzenesulfonate; methyl-(phenylmethyl)sulfanium Openeye Name: benzyl(methyl)sulfonium; 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonate; methyl-(phenylmethyl)sulfonium IUPAC Name: benzyl(methyl)sulfanium; 4-methylbenzenesulfonate Traditional Name: benzyl(methyl)sulfonium tosylate Formula: C15H18O3S2 MolecularWeight: 310.43162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10S.C7H8O3S/c1-9-7-8-5-3-2-4-6-8;1-6-2-4-7(5-3-6)11(8,9)10/h2-6H,7H2,1H3;2-5H,1H3,(H,8,9,10)