benzenesulfonate; (4-methoxyphenyl)-phenyl-iodanium

Systemtic Name: benzenesulfonate; (4-methoxyphenyl)-phenyl-iodanium Openeye Name: benzenesulfonate; (4-methoxyphenyl)-phenyl-iodonium CAS Name: benzenesulfonate; (4-methoxyphenyl)-phenyliodonium IUPAC Name: benzenesulfonate; (4-methoxyphenyl)-phenyliodanium Traditional Name: (4-methoxyphenyl)-phenyl-iodonium besylate Formula: C19H17IO4S MolecularWeight: 468.30535

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12IO.C6H6O3S/c1-15-13-9-7-12(8-10-13)14-11-5-3-2-4-6-11;7-10(8,9)6-4-2-1-3-5-6/h2-10H,1H3;1-5H,(H,7,8,9)/q+1;/p-1