bis(4-tert-butylphenyl)iodanium; methanesulfonate

Systemtic Name: bis(4-tert-butylphenyl)iodanium; methanesulfonate Openeye Name: bis(4-tert-butylphenyl)iodonium; methanesulfonate CAS Name: bis(4-tert-butylphenyl)iodonium; methanesulfonate IUPAC Name: bis(4-tert-butylphenyl)iodanium; methanesulfonate Traditional Name: bis(4-tert-butylphenyl)iodonium mesylate Formula: C21H29IO3S MolecularWeight: 488.42263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26I.CH4O3S/c1-19(2,3)15-7-11-17(12-8-15)21-18-13-9-16(10-14-18)20(4,5)6;1-5(2,3)4/h7-14H,1-6H3;1H3,(H,2,3,4)/q+1;/p-1