3-(3-butylimidazol-1-ium-1-yl)propane-1-sulfonic acid; tris(fluoranyl)methanesulfonate

Systemtic Name: 3-(3-butylimidazol-1-ium-1-yl)propane-1-sulfonic acid; tris(fluoranyl)methanesulfonate Openeye Name: 3-(3-butylimidazol-1-ium-1-yl)propane-1-sulfonic acid; trifluoromethanesulfonate CAS Name: 3-(3-butyl-1-imidazol-1-iumyl)-1-propanesulfonic acid; trifluoromethanesulfonate IUPAC Name: 3-(3-butylimidazol-1-ium-1-yl)propane-1-sulfonic acid; trifluoromethanesulfonate Traditional Name: 3-(3-butylimidazol-1-ium-1-yl)propane-1-sulfonic acid triflate Formula: C11H19F3N2O6S2 MolecularWeight: 396.40357

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C[N+](=C1)CCCS(=O)(=O)O.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCCN1C=C[N+](=C1)CCCS(=O)(=O)O.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C10H18N2O3S.CHF3O3S/c1-2-3-5-11-7-8-12(10-11)6-4-9-16(13,14)15;2-1(3,4)8(5,6)7/h7-8,10H,2-6,9H2,1H3;(H,5,6,7)