disodium 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: disodium 5-nitrobenzene-1,3-dicarboxylate Openeye Name: disodium 5-nitrobenzene-1,3-dicarboxylate CAS Name: disodium 5-nitrobenzene-1,3-dicarboxylate IUPAC Name: disodium 5-nitrobenzene-1,3-dicarboxylate Traditional Name: disodium 5-nitroisophthalate Formula: C8H3NNa2O6 MolecularWeight: 255.09206

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)[O-])[N+](=O)[O-])C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=C(C=C(C=C1C(=O)[O-])[N+](=O)[O-])C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C8H5NO6.2Na/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;;/h1-3H,(H,10,11)(H,12,13);;/q;2*+1/p-2