bis(4-methylphenyl)iodanium; 2,4,5-tris(chloranyl)benzenesulfonate

Systemtic Name: bis(4-methylphenyl)iodanium; 2,4,5-tris(chloranyl)benzenesulfonate Openeye Name: bis-p-tolyliodonium; 2,4,5-trichlorobenzenesulfonate CAS Name: bis(4-methylphenyl)iodonium; 2,4,5-trichlorobenzenesulfonate IUPAC Name: bis(4-methylphenyl)iodanium; 2,4,5-trichlorobenzenesulfonate Traditional Name: bis-p-tolyliodonium; 2,4,5-trichlorobesylate Formula: C20H16Cl3IO3S MolecularWeight: 569.66771

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C.C1=C(C(=CC(=C1Cl)Cl)Cl)S(=O)(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C.C1=C(C(=CC(=C1Cl)Cl)Cl)S(=O)(=O)[O-]

InChI

InChI=1S/C14H14I.C6H3Cl3O3S/c1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;7-3-1-5(9)6(2-4(3)8)13(10,11)12/h3-10H,1-2H3;1-2H,(H,10,11,12)/q+1;/p-1