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

Systemtic Name: bis[4-(2-methylbutan-2-yl)phenyl]iodanium; propyl sulfate Openeye Name: bis[4-(1,1-dimethylpropyl)phenyl]iodonium; propyl sulfate CAS Name: bis[4-(2-methylbutan-2-yl)phenyl]iodonium; propyl sulfate IUPAC Name: bis[4-(2-methylbutan-2-yl)phenyl]iodanium; propyl sulfate Traditional Name: bis(4-tert-amylphenyl)iodonium; propyl sulfate Formula: C25H37IO4S MolecularWeight: 560.52835

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30I.C3H8O4S/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;1-2-3-7-8(4,5)6/h9-16H,7-8H2,1-6H3;2-3H2,1H3,(H,4,5,6)/q+1;/p-1