2,4,6-triphenyl-1-propyl-pyridin-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 2,4,6-triphenyl-1-propyl-pyridin-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: trifluoromethanesulfonate; 2,4,6-triphenyl-1-propyl-pyridin-1-ium CAS Name: trifluoromethanesulfonate; 2,4,6-triphenyl-1-propylpyridin-1-ium IUPAC Name: trifluoromethanesulfonate; 2,4,6-triphenyl-1-propylpyridin-1-ium Traditional Name: 2,4,6-triphenyl-1-propyl-pyridin-1-ium triflate Formula: C27H24F3NO3S MolecularWeight: 499.54457

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24N.CHF3O3S/c1-2-18-27-25(22-14-8-4-9-15-22)19-24(21-12-6-3-7-13-21)20-26(27)23-16-10-5-11-17-23;2-1(3,4)8(5,6)7/h3-17,19-20H,2,18H2,1H3;(H,5,6,7)/q+1;/p-1