[(E)-3-chloranyl-2-(trifluoromethylsulfonyloxy)prop-1-enyl]-[4-[(E)-3-chloranyl-2-(trifluoromethylsulfonyloxy)prop-1-enyl]iodoniophenyl]iodanium; tris(fluoranyl)methanesulfonate

Systemtic Name: [(E)-3-chloranyl-2-(trifluoromethylsulfonyloxy)prop-1-enyl]-[4-[(E)-3-chloranyl-2-(trifluoromethylsulfonyloxy)prop-1-enyl]iodoniophenyl]iodanium; tris(fluoranyl)methanesulfonate Openeye Name: [(E)-3-chloro-2-(trifluoromethylsulfonyloxy)prop-1-enyl]-[4-[(E)-3-chloro-2-(trifluoromethylsulfonyloxy)prop-1-enyl]iodoniophenyl]iodonium; trifluoromethanesulfonate CAS Name: [(E)-3-chloro-2-(trifluoromethylsulfonyloxy)prop-1-enyl]-[4-[(E)-3-chloro-2-(trifluoromethylsulfonyloxy)prop-1-enyl]iodoniophenyl]iodonium; trifluoromethanesulfonate IUPAC Name: [(E)-3-chloro-2-(trifluoromethylsulfonyloxy)prop-1-enyl]-[4-[(E)-3-chloro-2-(trifluoromethylsulfonyloxy)prop-1-enyl]iodoniophenyl]iodanium; trifluoromethanesulfonate Traditional Name: [(E)-3-chloro-2-triflyloxy-prop-1-enyl]-[4-[(E)-3-chloro-2-triflyloxy-prop-1-enyl]iodoniophenyl]iodonium ditriflate Formula: C16H10Cl2F12I2O12S4 MolecularWeight: 1075.199178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[I+]C=C(CCl)OS(=O)(=O)C(F)(F)F)[I+]C=C(CCl)OS(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[I+]/C=C(/OS(=O)(=O)C(F)(F)F)\CCl)[I+]/C=C(/OS(=O)(=O)C(F)(F)F)\CCl.C(S(=O)(=O)[O-])(F)(F)F.C(S(=O)(=O)[O-])(F)(F)F

InChI

InChI=1S/C14H10Cl2F6I2O6S2.2CHF3O3S/c15-5-11(29-31(25,26)13(17,18)19)7-23-9-1-2-10(4-3-9)24-8-12(6-16)30-32(27,28)14(20,21)22;2*2-1(3,4)8(5,6)7/h1-4,7-8H,5-6H2;2*(H,5,6,7)/q+2;;/p-2/b11-7+,12-8+;;