1-butyl-2-ethyl-pyrazol-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-butyl-2-ethyl-pyrazol-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-butyl-2-ethyl-pyrazol-1-ium; trifluoromethanesulfonate CAS Name: 1-butyl-2-ethylpyrazol-1-ium; trifluoromethanesulfonate IUPAC Name: 1-butyl-2-ethylpyrazol-1-ium; trifluoromethanesulfonate Traditional Name: 1-butyl-2-ethyl-pyrazol-1-ium triflate Formula: C10H17F3N2O3S MolecularWeight: 302.31379

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CC=CN1CC.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCC[N+]1=CC=CN1CC.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C9H17N2.CHF3O3S/c1-3-5-7-11-9-6-8-10(11)4-2;2-1(3,4)8(5,6)7/h6,8-9H,3-5,7H2,1-2H3;(H,5,6,7)/q+1;/p-1