3-nitro-4-oxidanyl-benzenesulfonic acid; sodium

Systemtic Name: 3-nitro-4-oxidanyl-benzenesulfonic acid; sodium Openeye Name: 4-hydroxy-3-nitro-benzenesulfonic acid; sodium CAS Name: 4-hydroxy-3-nitrobenzenesulfonic acid; sodium IUPAC Name: 4-hydroxy-3-nitrobenzenesulfonic acid; sodium Traditional Name: 4-hydroxy-3-nitro-besylic acid; sodium Formula: C6H5NNaO6S MolecularWeight: 242.16177

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)O)[N+](=O)[O-])O.[Na]

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)O)[N+](=O)[O-])O.[Na]

InChI

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