phenyl-(4-phenyliodoniophenyl)iodanium; tris(fluoranyl)methanesulfonate

Systemtic Name: phenyl-(4-phenyliodoniophenyl)iodanium; tris(fluoranyl)methanesulfonate Openeye Name: phenyl-(4-phenyliodoniophenyl)iodonium; trifluoromethanesulfonate CAS Name: phenyl-(4-phenyliodoniophenyl)iodonium; trifluoromethanesulfonate IUPAC Name: phenyl-(4-phenyliodoniophenyl)iodanium; trifluoromethanesulfonate Traditional Name: phenyl-(4-phenyliodoniophenyl)iodonium ditriflate Formula: C20H14F6I2O6S2 MolecularWeight: 782.250919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14I2.2CHF3O3S/c1-3-7-15(8-4-1)19-17-11-13-18(14-12-17)20-16-9-5-2-6-10-16;2*2-1(3,4)8(5,6)7/h1-14H;2*(H,5,6,7)/q+2;;/p-2