1,3-dibutylimidazol-1-ium-4-sulfinate; tris(fluoranyl)methanesulfonate

Systemtic Name: 1,3-dibutylimidazol-1-ium-4-sulfinate; tris(fluoranyl)methanesulfonate Openeye Name: 1,3-dibutylimidazol-1-ium-4-sulfinate; trifluoromethanesulfonate CAS Name: 1,3-dibutyl-4-imidazol-1-iumsulfinate; trifluoromethanesulfonate IUPAC Name: 1,3-dibutylimidazol-1-ium-4-sulfinate; trifluoromethanesulfonate Traditional Name: 1,3-dibutylimidazol-1-ium-4-sulfinate triflate Formula: C12H20F3N2O5S2- MolecularWeight: 393.42281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=[N+](C=C1S(=O)[O-])CCCC.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCCN1C=[N+](C=C1S(=O)[O-])CCCC.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C11H20N2O2S.CHF3O3S/c1-3-5-7-12-9-11(16(14)15)13(10-12)8-6-4-2;2-1(3,4)8(5,6)7/h9-10H,3-8H2,1-2H3;(H,5,6,7)/p-1