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2-diphenylphosphanylethyl-methyl-diphenyl-phosphanium; tris(fluoranyl)methanesulfonate

2-diphenylphosphanylethyl-methyl-diphenyl-phosphanium; tris(fluoranyl)methanesulfonate

Systemtic Name:2-diphenylphosphanylethyl-methyl-diphenyl-phosphanium; tris(fluoranyl)methanesulfonate
Openeye Name:2-diphenylphosphanylethyl-methyl-diphenyl-phosphonium; trifluoromethanesulfonate
CAS Name:2-diphenylphosphinoethyl-methyl-diphenylphosphonium; trifluoromethanesulfonate
IUPAC Name:2-diphenylphosphanylethyl-methyl-diphenylphosphanium; trifluoromethanesulfonate
Traditional Name:2-diphenylphosphinoethyl-methyl-diphenyl-phosphonium triflate
Formula: C28H27F3O3P2S
MolecularWeight: 562.519912
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C27H27P2.CHF3O3S/c1-29(26-18-10-4-11-19-26,27-20-12-5-13-21-27)23-22-28(24-14-6-2-7-15-24)25-16-8-3-9-17-25;2-1(3,4)8(5,6)7/h2-21H,22-23H2,1H3;(H,5,6,7)/q+1;/p-1


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