2-azanyl-3-iodanyl-5-nitro-benzenesulfonic acid

Systemtic Name: 2-azanyl-3-iodanyl-5-nitro-benzenesulfonic acid Openeye Name: 2-amino-3-iodo-5-nitro-benzenesulfonic acid CAS Name: 2-amino-3-iodo-5-nitrobenzenesulfonic acid IUPAC Name: 2-amino-3-iodo-5-nitrobenzenesulfonic acid Traditional Name: 2-amino-3-iodo-5-nitro-besylic acid Formula: C6H5IN2O5S MolecularWeight: 344.08377

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1S(=O)(=O)O)N)I)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1S(=O)(=O)O)N)I)[N+](=O)[O-]

InChI

InChI=1S/C6H5IN2O5S/c7-4-1-3(9(10)11)2-5(6(4)8)15(12,13)14/h1-2H,8H2,(H,12,13,14)