bis(4-propylphenyl)iodanium; 2-(trifluoromethyl)benzenesulfonate

Systemtic Name: bis(4-propylphenyl)iodanium; 2-(trifluoromethyl)benzenesulfonate Openeye Name: bis(4-propylphenyl)iodonium; 2-(trifluoromethyl)benzenesulfonate CAS Name: bis(4-propylphenyl)iodonium; 2-(trifluoromethyl)benzenesulfonate IUPAC Name: bis(4-propylphenyl)iodanium; 2-(trifluoromethyl)benzenesulfonate Traditional Name: bis(4-propylphenyl)iodonium; 2-(trifluoromethyl)besylate Formula: C25H26F3IO3S MolecularWeight: 590.43682

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)CCC.C1=CC=C(C(=C1)C(F)(F)F)S(=O)(=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)CCC.C1=CC=C(C(=C1)C(F)(F)F)S(=O)(=O)[O-]

InChI

InChI=1S/C18H22I.C7H5F3O3S/c1-3-5-15-7-11-17(12-8-15)19-18-13-9-16(6-4-2)10-14-18;8-7(9,10)5-3-1-2-4-6(5)14(11,12)13/h7-14H,3-6H2,1-2H3;1-4H,(H,11,12,13)/q+1;/p-1