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4-methylbenzenesulfonate; octadecyl(diphenyl)sulfanium

4-methylbenzenesulfonate; octadecyl(diphenyl)sulfanium

Systemtic Name:4-methylbenzenesulfonate; octadecyl(diphenyl)sulfanium
Openeye Name:4-methylbenzenesulfonate; octadecyl(diphenyl)sulfonium
CAS Name:4-methylbenzenesulfonate; octadecyl(diphenyl)sulfonium
IUPAC Name:4-methylbenzenesulfonate; octadecyl(diphenyl)sulfanium
Traditional Name:diphenyl(stearyl)sulfonium tosylate
Formula: C37H54O3S2
MolecularWeight: 610.95286
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C30H47S.C7H8O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-28-31(29-24-19-17-20-25-29)30-26-21-18-22-27-30;1-6-2-4-7(5-3-6)11(8,9)10/h17-22,24-27H,2-16,23,28H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1


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