2,3,4,6-tetraphenyl-1-pyridin-4-yl-pyridin-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 2,3,4,6-tetraphenyl-1-pyridin-4-yl-pyridin-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 2,3,4,6-tetraphenyl-1-(4-pyridyl)pyridin-1-ium; trifluoromethanesulfonate CAS Name: 2,3,4,6-tetraphenyl-1-pyridin-4-ylpyridin-1-ium; trifluoromethanesulfonate IUPAC Name: 2,3,4,6-tetraphenyl-1-pyridin-4-ylpyridin-1-ium; trifluoromethanesulfonate Traditional Name: 2,3,4,6-tetraphenyl-1-(4-pyridyl)pyridin-1-ium triflate Formula: C35H25F3N2O3S MolecularWeight: 610.64481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=NC=C5)C6=CC=CC=C6.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=NC=C5)C6=CC=CC=C6.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C34H25N2.CHF3O3S/c1-5-13-26(14-6-1)31-25-32(27-15-7-2-8-16-27)36(30-21-23-35-24-22-30)34(29-19-11-4-12-20-29)33(31)28-17-9-3-10-18-28;2-1(3,4)8(5,6)7/h1-25H;(H,5,6,7)/q+1;/p-1