triphenylsulfanium; 1,1,2-tris(fluoranyl)octane-1-sulfonate

Systemtic Name: triphenylsulfanium; 1,1,2-tris(fluoranyl)octane-1-sulfonate Openeye Name: 1,1,2-trifluorooctane-1-sulfonate; triphenylsulfonium CAS Name: 1,1,2-trifluoro-1-octanesulfonate; triphenylsulfonium IUPAC Name: 1,1,2-trifluorooctane-1-sulfonate; triphenylsulfanium Traditional Name: 1,1,2-trifluorooctane-1-sulfonate; triphenylsulfonium Formula: C26H29F3O3S2 MolecularWeight: 510.63187

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15S.C8H15F3O3S/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-3-4-5-6-7(9)8(10,11)15(12,13)14/h1-15H;7H,2-6H2,1H3,(H,12,13,14)/q+1;/p-1