bis(4-propan-2-ylphenyl)iodanium; 2-(trifluoromethyl)benzenesulfonate

Systemtic Name: bis(4-propan-2-ylphenyl)iodanium; 2-(trifluoromethyl)benzenesulfonate Openeye Name: bis(4-isopropylphenyl)iodonium; 2-(trifluoromethyl)benzenesulfonate CAS Name: bis(4-propan-2-ylphenyl)iodonium; 2-(trifluoromethyl)benzenesulfonate IUPAC Name: bis(4-propan-2-ylphenyl)iodanium; 2-(trifluoromethyl)benzenesulfonate Traditional Name: bis(p-cumenyl)iodonium; 2-(trifluoromethyl)besylate Formula: C25H26F3IO3S MolecularWeight: 590.43682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22I.C7H5F3O3S/c1-13(2)15-5-9-17(10-6-15)19-18-11-7-16(8-12-18)14(3)4;8-7(9,10)5-3-1-2-4-6(5)14(11,12)13/h5-14H,1-4H3;1-4H,(H,11,12,13)/q+1;/p-1