bis(4-chlorophenyl)iodanium; octane-1-sulfonate

Systemtic Name: bis(4-chlorophenyl)iodanium; octane-1-sulfonate Openeye Name: bis(4-chlorophenyl)iodonium; octane-1-sulfonate CAS Name: bis(4-chlorophenyl)iodonium; 1-octanesulfonate IUPAC Name: bis(4-chlorophenyl)iodanium; octane-1-sulfonate Traditional Name: bis(4-chlorophenyl)iodonium; octane-1-sulfonate Formula: C20H25Cl2IO3S MolecularWeight: 543.28617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)[O-].C1=CC(=CC=C1Cl)[I+]C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCCCS(=O)(=O)[O-].C1=CC(=CC=C1Cl)[I+]C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H8Cl2I.C8H18O3S/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12;1-2-3-4-5-6-7-8-12(9,10)11/h1-8H;2-8H2,1H3,(H,9,10,11)/q+1;/p-1