bis(4-tert-butylphenyl)iodanium; 4-(4-methylphenyl)sulfonyloxynaphthalene-1-sulfonate

Systemtic Name: bis(4-tert-butylphenyl)iodanium; 4-(4-methylphenyl)sulfonyloxynaphthalene-1-sulfonate Openeye Name: bis(4-tert-butylphenyl)iodonium; 4-(p-tolylsulfonyloxy)naphthalene-1-sulfonate CAS Name: bis(4-tert-butylphenyl)iodonium; 4-(4-methylphenyl)sulfonyloxy-1-naphthalenesulfonate IUPAC Name: bis(4-tert-butylphenyl)iodanium; 4-(4-methylphenyl)sulfonyloxynaphthalene-1-sulfonate Traditional Name: bis(4-tert-butylphenyl)iodonium; 4-tosyloxynaphthalene-1-sulfonate Formula: C37H39IO6S2 MolecularWeight: 770.73643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C3=CC=CC=C32)S(=O)(=O)[O-].CC(C)(C)C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C3=CC=CC=C32)S(=O)(=O)[O-].CC(C)(C)C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H26I.C17H14O6S2/c1-19(2,3)15-7-11-17(12-8-15)21-18-13-9-16(10-14-18)20(4,5)6;1-12-6-8-13(9-7-12)25(21,22)23-16-10-11-17(24(18,19)20)15-5-3-2-4-14(15)16/h7-14H,1-6H3;2-11H,1H3,(H,18,19,20)/q+1;/p-1