(3-iodanylphenyl) 3-bromanyl-4-nitro-benzenesulfonate

Systemtic Name: (3-iodanylphenyl) 3-bromanyl-4-nitro-benzenesulfonate Openeye Name: (3-iodophenyl) 3-bromo-4-nitro-benzenesulfonate CAS Name: 3-bromo-4-nitrobenzenesulfonic acid (3-iodophenyl) ester IUPAC Name: (3-iodophenyl) 3-bromo-4-nitrobenzenesulfonate Traditional Name: 3-bromo-4-nitro-benzenesulfonic acid (3-iodophenyl) ester Formula: C12H7BrINO5S MolecularWeight: 484.06115

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)OS(=O)(=O)C2=CC(=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC(=C1)I)OS(=O)(=O)C2=CC(=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C12H7BrINO5S/c13-11-7-10(4-5-12(11)15(16)17)21(18,19)20-9-3-1-2-8(14)6-9/h1-7H