bis(4-tert-butylphenyl)iodanium; 2,5-bis(chloranyl)benzenesulfonate

Systemtic Name: bis(4-tert-butylphenyl)iodanium; 2,5-bis(chloranyl)benzenesulfonate Openeye Name: bis(4-tert-butylphenyl)iodonium; 2,5-dichlorobenzenesulfonate CAS Name: bis(4-tert-butylphenyl)iodonium; 2,5-dichlorobenzenesulfonate IUPAC Name: bis(4-tert-butylphenyl)iodanium; 2,5-dichlorobenzenesulfonate Traditional Name: bis(4-tert-butylphenyl)iodonium; 2,5-dichlorobesylate Formula: C26H29Cl2IO3S MolecularWeight: 619.38213

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26I.C6H4Cl2O3S/c1-19(2,3)15-7-11-17(12-8-15)21-18-13-9-16(10-14-18)20(4,5)6;7-4-1-2-5(8)6(3-4)12(9,10)11/h7-14H,1-6H3;1-3H,(H,9,10,11)/q+1;/p-1