1-hexyl-2,3-dimethyl-imidazol-3-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-hexyl-2,3-dimethyl-imidazol-3-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-hexyl-2,3-dimethyl-imidazol-3-ium; trifluoromethanesulfonate CAS Name: 1-hexyl-2,3-dimethylimidazol-3-ium; trifluoromethanesulfonate IUPAC Name: 1-hexyl-2,3-dimethylimidazol-3-ium; trifluoromethanesulfonate Traditional Name: 1-hexyl-2,3-dimethyl-imidazol-3-ium triflate Formula: C12H21F3N2O3S MolecularWeight: 330.36695

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C11H21N2.CHF3O3S/c1-4-5-6-7-8-13-10-9-12(3)11(13)2;2-1(3,4)8(5,6)7/h9-10H,4-8H2,1-3H3;(H,5,6,7)/q+1;/p-1