bis(4-methoxyphenyl)iodanium; 4-methylbenzenesulfonate

Systemtic Name: bis(4-methoxyphenyl)iodanium; 4-methylbenzenesulfonate Openeye Name: bis(4-methoxyphenyl)iodonium; 4-methylbenzenesulfonate CAS Name: bis(4-methoxyphenyl)iodonium; 4-methylbenzenesulfonate IUPAC Name: bis(4-methoxyphenyl)iodanium; 4-methylbenzenesulfonate Traditional Name: bis(4-methoxyphenyl)iodonium tosylate Formula: C21H21IO5S MolecularWeight: 512.35791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].COC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].COC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)OC

InChI

InChI=1S/C14H14IO2.C7H8O3S/c1-16-13-7-3-11(4-8-13)15-12-5-9-14(17-2)10-6-12;1-6-2-4-7(5-3-6)11(8,9)10/h3-10H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1