1-methyl-3-octyl-imidazol-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-methyl-3-octyl-imidazol-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-methyl-3-octyl-imidazol-1-ium; trifluoromethanesulfonate CAS Name: 1-methyl-3-octylimidazol-1-ium; trifluoromethanesulfonate IUPAC Name: 1-methyl-3-octylimidazol-1-ium; trifluoromethanesulfonate Traditional Name: 1-methyl-3-octyl-imidazol-1-ium triflate Formula: C13H23F3N2O3S MolecularWeight: 344.39353

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C12H23N2.CHF3O3S/c1-3-4-5-6-7-8-9-14-11-10-13(2)12-14;2-1(3,4)8(5,6)7/h10-12H,3-9H2,1-2H3;(H,5,6,7)/q+1;/p-1