4,6-dinitro-5-oxidanyl-benzene-1,3-dicarboxylic acid

Systemtic Name: 4,6-dinitro-5-oxidanyl-benzene-1,3-dicarboxylic acid Openeye Name: 5-hydroxy-4,6-dinitro-benzene-1,3-dicarboxylic acid CAS Name: 5-hydroxy-4,6-dinitrobenzene-1,3-dicarboxylic acid IUPAC Name: 5-hydroxy-4,6-dinitrobenzene-1,3-dicarboxylic acid Traditional Name: 5-hydroxy-4,6-dinitro-isophthalic acid Formula: C8H4N2O9 MolecularWeight: 272.12536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H4N2O9/c11-6-4(9(16)17)2(7(12)13)1-3(8(14)15)5(6)10(18)19/h1,11H,(H,12,13)(H,14,15)