diphenyliodanium; 4-(4-methylphenyl)sulfonyloxybenzenesulfonate

Systemtic Name: diphenyliodanium; 4-(4-methylphenyl)sulfonyloxybenzenesulfonate Openeye Name: diphenyliodonium; 4-(p-tolylsulfonyloxy)benzenesulfonate CAS Name: diphenyliodonium; 4-(4-methylphenyl)sulfonyloxybenzenesulfonate IUPAC Name: diphenyliodanium; 4-(4-methylphenyl)sulfonyloxybenzenesulfonate Traditional Name: diphenyliodonium; 4-tosyloxybesylate Formula: C25H21IO6S2 MolecularWeight: 608.46511

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12O6S2.C12H10I/c1-10-2-6-13(7-3-10)21(17,18)19-11-4-8-12(9-5-11)20(14,15)16;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h2-9H,1H3,(H,14,15,16);1-10H/q;+1/p-1