(4-methylphenyl)-[4-(2-methylpropyl)phenyl]iodanium; phenyl sulfate

Systemtic Name: (4-methylphenyl)-[4-(2-methylpropyl)phenyl]iodanium; phenyl sulfate Openeye Name: (4-isobutylphenyl)-(p-tolyl)iodonium; phenyl sulfate CAS Name: (4-methylphenyl)-[4-(2-methylpropyl)phenyl]iodonium; phenyl sulfate IUPAC Name: (4-methylphenyl)-[4-(2-methylpropyl)phenyl]iodanium; phenyl sulfate Traditional Name: (4-isobutylphenyl)-(p-tolyl)iodonium; phenyl sulfate Formula: C23H25IO4S MolecularWeight: 524.41167

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20I.C6H6O4S/c1-13(2)12-15-6-10-17(11-7-15)18-16-8-4-14(3)5-9-16;7-11(8,9)10-6-4-2-1-3-5-6/h4-11,13H,12H2,1-3H3;1-5H,(H,7,8,9)/q+1;/p-1