(4-tert-butylphenyl)-(4-methylphenyl)iodanium; 4-chloranylbenzenesulfonate

Systemtic Name: (4-tert-butylphenyl)-(4-methylphenyl)iodanium; 4-chloranylbenzenesulfonate Openeye Name: (4-tert-butylphenyl)-(p-tolyl)iodonium; 4-chlorobenzenesulfonate CAS Name: (4-tert-butylphenyl)-(4-methylphenyl)iodonium; 4-chlorobenzenesulfonate IUPAC Name: (4-tert-butylphenyl)-(4-methylphenyl)iodanium; 4-chlorobenzenesulfonate Traditional Name: (4-tert-butylphenyl)-(p-tolyl)iodonium; 4-chlorobesylate Formula: C23H24ClIO3S MolecularWeight: 542.85733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)C.C1=CC(=CC=C1S(=O)(=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)C.C1=CC(=CC=C1S(=O)(=O)[O-])Cl

InChI

InChI=1S/C17H20I.C6H5ClO3S/c1-13-5-9-15(10-6-13)18-16-11-7-14(8-12-16)17(2,3)4;7-5-1-3-6(4-2-5)11(8,9)10/h5-12H,1-4H3;1-4H,(H,8,9,10)/q+1;/p-1