1-nitrocyclohexa-3,5-diene-1,3-dicarboxylate

Systemtic Name: 1-nitrocyclohexa-3,5-diene-1,3-dicarboxylate Openeye Name: 1-nitrocyclohexa-3,5-diene-1,3-dicarboxylate CAS Name: 1-nitrocyclohexa-3,5-diene-1,3-dicarboxylate IUPAC Name: 1-nitrocyclohexa-3,5-diene-1,3-dicarboxylate Traditional Name: 1-nitrocyclohexa-3,5-diene-1,3-dicarboxylate Formula: C8H5NO6-2 MolecularWeight: 211.1284

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC=CC1(C(=O)[O-])[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1C(=CC=CC1(C(=O)[O-])[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C8H7NO6/c10-6(11)5-2-1-3-8(4-5,7(12)13)9(14)15/h1-3H,4H2,(H,10,11)(H,12,13)/p-2