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

Systemtic Name: 1-(3-methoxyphenyl)-3-methyl-imidazol-3-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-(3-methoxyphenyl)-3-methyl-imidazol-3-ium; trifluoromethanesulfonate CAS Name: 1-(3-methoxyphenyl)-3-methylimidazol-3-ium; trifluoromethanesulfonate IUPAC Name: 1-(3-methoxyphenyl)-3-methylimidazol-3-ium; trifluoromethanesulfonate Traditional Name: 1-(3-methoxyphenyl)-3-methyl-imidazol-3-ium triflate Formula: C12H13F3N2O4S MolecularWeight: 338.30283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)C2=CC(=CC=C2)OC.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=CN(C=C1)C2=CC(=CC=C2)OC.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C11H13N2O.CHF3O3S/c1-12-6-7-13(9-12)10-4-3-5-11(8-10)14-2;2-1(3,4)8(5,6)7/h3-9H,1-2H3;(H,5,6,7)/q+1;/p-1