bis(2-tert-butylphenyl)iodanium; 4-methoxybenzenesulfonate

Systemtic Name: bis(2-tert-butylphenyl)iodanium; 4-methoxybenzenesulfonate Openeye Name: bis(2-tert-butylphenyl)iodonium; 4-methoxybenzenesulfonate CAS Name: bis(2-tert-butylphenyl)iodonium; 4-methoxybenzenesulfonate IUPAC Name: bis(2-tert-butylphenyl)iodanium; 4-methoxybenzenesulfonate Traditional Name: bis(2-tert-butylphenyl)iodonium; 4-methoxybesylate Formula: C27H33IO4S MolecularWeight: 580.51799

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1[I+]C2=CC=CC=C2C(C)(C)C.COC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1[I+]C2=CC=CC=C2C(C)(C)C.COC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C20H26I.C7H8O4S/c1-19(2,3)15-11-7-9-13-17(15)21-18-14-10-8-12-16(18)20(4,5)6;1-11-6-2-4-7(5-3-6)12(8,9)10/h7-14H,1-6H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1