3-nitro-2-oxidanyl-benzenesulfonic acid

Systemtic Name: 3-nitro-2-oxidanyl-benzenesulfonic acid Openeye Name: 2-hydroxy-3-nitro-benzenesulfonic acid CAS Name: 2-hydroxy-3-nitrobenzenesulfonic acid IUPAC Name: 2-hydroxy-3-nitrobenzenesulfonic acid Traditional Name: 2-hydroxy-3-nitro-besylic acid Formula: C6H5NO6S MolecularWeight: 219.172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H5NO6S/c8-6-4(7(9)10)2-1-3-5(6)14(11,12)13/h1-3,8H,(H,11,12,13)