benzene; 4-methylbenzenesulfonate; methylsulfanium

Systemtic Name: benzene; 4-methylbenzenesulfonate; methylsulfanium Openeye Name: benzene; 4-methylbenzenesulfonate; methylsulfonium CAS Name: benzene; 4-methylbenzenesulfonate; methylsulfonium IUPAC Name: benzene; 4-methylbenzenesulfonate; methylsulfanium Traditional Name: benzene; methylsulfonium; tosylate Formula: C14H18O3S2 MolecularWeight: 298.42092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8O3S.C6H6.CH4S/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-4-6-5-3-1;1-2/h2-5H,1H3,(H,8,9,10);1-6H;2H,1H3