5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: 5-nitrobenzene-1,3-dicarboxylate Openeye Name: 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylate IUPAC Name: 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitroisophthalate Formula: C8H3NO6-2 MolecularWeight: 209.11252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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