1-octylpyridin-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-octylpyridin-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-octylpyridin-1-ium; trifluoromethanesulfonate CAS Name: 1-octylpyridin-1-ium; trifluoromethanesulfonate IUPAC Name: 1-octylpyridin-1-ium; trifluoromethanesulfonate Traditional Name: 1-octylpyridin-1-ium triflate Formula: C14H22F3NO3S MolecularWeight: 341.38959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N.CHF3O3S/c1-2-3-4-5-6-8-11-14-12-9-7-10-13-14;2-1(3,4)8(5,6)7/h7,9-10,12-13H,2-6,8,11H2,1H3;(H,5,6,7)/q+1;/p-1