(4-methylphenyl)sulfanium; octane-1-sulfonate

Systemtic Name: (4-methylphenyl)sulfanium; octane-1-sulfonate Openeye Name: octane-1-sulfonate; p-tolylsulfonium CAS Name: (4-methylphenyl)sulfonium; 1-octanesulfonate IUPAC Name: (4-methylphenyl)sulfanium; octane-1-sulfonate Traditional Name: octane-1-sulfonate; p-tolylsulfonium Formula: C15H26O3S2 MolecularWeight: 318.49514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H18O3S.C7H8S/c1-2-3-4-5-6-7-8-12(9,10)11;1-6-2-4-7(8)5-3-6/h2-8H2,1H3,(H,9,10,11);2-5,8H,1H3