bis[4-(2-methylbutan-2-yl)phenyl]iodanium; (4-tert-butylphenyl) sulfate

Systemtic Name: bis[4-(2-methylbutan-2-yl)phenyl]iodanium; (4-tert-butylphenyl) sulfate Openeye Name: bis[4-(1,1-dimethylpropyl)phenyl]iodonium; (4-tert-butylphenyl) sulfate CAS Name: bis[4-(2-methylbutan-2-yl)phenyl]iodonium; (4-tert-butylphenyl) sulfate IUPAC Name: bis[4-(2-methylbutan-2-yl)phenyl]iodanium; (4-tert-butylphenyl) sulfate Traditional Name: bis(4-tert-amylphenyl)iodonium; (4-tert-butylphenyl) sulfate Formula: C32H43IO4S MolecularWeight: 650.65089

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)CC.CC(C)(C)C1=CC=C(C=C1)OS(=O)(=O)[O-]

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)CC.CC(C)(C)C1=CC=C(C=C1)OS(=O)(=O)[O-]

InChI

InChI=1S/C22H30I.C10H14O4S/c1-7-21(3,4)17-9-13-19(14-10-17)23-20-15-11-18(12-16-20)22(5,6)8-2;1-10(2,3)8-4-6-9(7-5-8)14-15(11,12)13/h9-16H,7-8H2,1-6H3;4-7H,1-3H3,(H,11,12,13)/q+1;/p-1