1-methyl-3,4,5-triphenyl-imidazol-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-methyl-3,4,5-triphenyl-imidazol-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-methyl-3,4,5-triphenyl-imidazol-1-ium; trifluoromethanesulfonate CAS Name: 1-methyl-3,4,5-triphenylimidazol-1-ium; trifluoromethanesulfonate IUPAC Name: 1-methyl-3,4,5-triphenylimidazol-1-ium; trifluoromethanesulfonate Traditional Name: 1-methyl-3,4,5-triphenyl-imidazol-1-ium triflate Formula: C23H19F3N2O3S MolecularWeight: 460.46877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C(=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=CN(C(=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C22H19N2.CHF3O3S/c1-23-17-24(20-15-9-4-10-16-20)22(19-13-7-3-8-14-19)21(23)18-11-5-2-6-12-18;2-1(3,4)8(5,6)7/h2-17H,1H3;(H,5,6,7)/q+1;/p-1