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

Systemtic Name: 1,3-dimethyl-2-nitro-imidazol-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1,3-dimethyl-2-nitro-imidazol-1-ium; trifluoromethanesulfonate CAS Name: 1,3-dimethyl-2-nitroimidazol-1-ium; trifluoromethanesulfonate IUPAC Name: 1,3-dimethyl-2-nitroimidazol-1-ium; trifluoromethanesulfonate Traditional Name: 1,3-dimethyl-2-nitro-imidazol-1-ium triflate Formula: C6H8F3N3O5S MolecularWeight: 291.20503

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C[N+](=C1[N+](=O)[O-])C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CN1C=C[N+](=C1[N+](=O)[O-])C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C5H8N3O2.CHF3O3S/c1-6-3-4-7(2)5(6)8(9)10;2-1(3,4)8(5,6)7/h3-4H,1-2H3;(H,5,6,7)/q+1;/p-1