2,6-bis(fluoranyl)benzenesulfonate; (2,4-dimethylphenyl)-diphenyl-sulfanium

Systemtic Name: 2,6-bis(fluoranyl)benzenesulfonate; (2,4-dimethylphenyl)-diphenyl-sulfanium Openeye Name: 2,6-difluorobenzenesulfonate; (2,4-dimethylphenyl)-diphenyl-sulfonium CAS Name: 2,6-difluorobenzenesulfonate; (2,4-dimethylphenyl)-diphenylsulfonium IUPAC Name: 2,6-difluorobenzenesulfonate; (2,4-dimethylphenyl)-diphenylsulfanium Traditional Name: 2,6-difluorobesylate; (2,4-dimethylphenyl)-diphenyl-sulfonium Formula: C26H22F2O3S2 MolecularWeight: 484.577886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3)C.C1=CC(=C(C(=C1)F)S(=O)(=O)[O-])F

Isomeric SMILES

CC1=CC(=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3)C.C1=CC(=C(C(=C1)F)S(=O)(=O)[O-])F

InChI

InChI=1S/C20H19S.C6H4F2O3S/c1-16-13-14-20(17(2)15-16)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19;7-4-2-1-3-5(8)6(4)12(9,10)11/h3-15H,1-2H3;1-3H,(H,9,10,11)/q+1;/p-1