benzenesulfonate; (4-nitrophenyl)-phenyl-iodanium

Systemtic Name: benzenesulfonate; (4-nitrophenyl)-phenyl-iodanium Openeye Name: benzenesulfonate; (4-nitrophenyl)-phenyl-iodonium CAS Name: benzenesulfonate; (4-nitrophenyl)-phenyliodonium IUPAC Name: benzenesulfonate; (4-nitrophenyl)-phenyliodanium Traditional Name: (4-nitrophenyl)-phenyl-iodonium besylate Formula: C18H14INO5S MolecularWeight: 483.27693

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9INO2.C6H6O3S/c15-14(16)12-8-6-11(7-9-12)13-10-4-2-1-3-5-10;7-10(8,9)6-4-2-1-3-5-6/h1-9H;1-5H,(H,7,8,9)/q+1;/p-1