triphenyl(triphenylphosphaniumyloxy)phosphanium; tris(fluoranyl)methanesulfonate

Systemtic Name: triphenyl(triphenylphosphaniumyloxy)phosphanium; tris(fluoranyl)methanesulfonate Openeye Name: trifluoromethanesulfonate; triphenyl(triphenylphosphaniumyloxy)phosphonium CAS Name: trifluoromethanesulfonate; triphenyl(triphenylphosphiniumyloxy)phosphonium IUPAC Name: trifluoromethanesulfonate; triphenyl(triphenylphosphaniumyloxy)phosphanium Traditional Name: triphenyl(triphenylphosphiniumyloxy)phosphonium ditriflate Formula: C38H30F6O7P2S2 MolecularWeight: 838.708541

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H30OP2.2CHF3O3S/c1-7-19-31(20-8-1)38(32-21-9-2-10-22-32,33-23-11-3-12-24-33)37-39(34-25-13-4-14-26-34,35-27-15-5-16-28-35)36-29-17-6-18-30-36;2*2-1(3,4)8(5,6)7/h1-30H;2*(H,5,6,7)/q+2;;/p-2