tert-butyl-methyl-(2-oxidanylideneoctyl)sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: tert-butyl-methyl-(2-oxidanylideneoctyl)sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: tert-butyl-methyl-(2-oxooctyl)sulfonium; trifluoromethanesulfonate CAS Name: tert-butyl-methyl-(2-oxooctyl)sulfonium; trifluoromethanesulfonate IUPAC Name: tert-butyl-methyl-(2-oxooctyl)sulfanium; trifluoromethanesulfonate Traditional Name: tert-butyl-(2-ketooctyl)-methyl-sulfonium triflate Formula: C14H27F3O4S2 MolecularWeight: 380.48699

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C[S+](C)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCC(=O)C[S+](C)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C13H27OS.CHF3O3S/c1-6-7-8-9-10-12(14)11-15(5)13(2,3)4;2-1(3,4)8(5,6)7/h6-11H2,1-5H3;(H,5,6,7)/q+1;/p-1