benzenesulfonate; bis(3-nitrophenyl)iodanium

Systemtic Name: benzenesulfonate; bis(3-nitrophenyl)iodanium Openeye Name: benzenesulfonate; bis(3-nitrophenyl)iodonium CAS Name: benzenesulfonate; bis(3-nitrophenyl)iodonium IUPAC Name: benzenesulfonate; bis(3-nitrophenyl)iodanium Traditional Name: bis(3-nitrophenyl)iodonium besylate Formula: C18H13IN2O7S MolecularWeight: 528.27449

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8IN2O4.C6H6O3S/c16-14(17)11-5-1-3-9(7-11)13-10-4-2-6-12(8-10)15(18)19;7-10(8,9)6-4-2-1-3-5-6/h1-8H;1-5H,(H,7,8,9)/q+1;/p-1