disodium 5-nitro-2-oxidanyl-benzenesulfonate

Systemtic Name: disodium 5-nitro-2-oxidanyl-benzenesulfonate Openeye Name: disodium 2-hydroxy-5-nitro-benzenesulfonate CAS Name: disodium 2-hydroxy-5-nitrobenzenesulfonate IUPAC Name: disodium 2-hydroxy-5-nitrobenzenesulfonate Traditional Name: disodium 2-hydroxy-5-nitro-besylate Formula: C12H8N2Na2O12S2 MolecularWeight: 482.30766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C6H5NO6S.2Na/c2*8-5-2-1-4(7(9)10)3-6(5)14(11,12)13;;/h2*1-3,8H,(H,11,12,13);;/q;;2*+1/p-2