2,4,6-trinitro-3-oxidanyl-benzoic acid

Systemtic Name: 2,4,6-trinitro-3-oxidanyl-benzoic acid Openeye Name: 3-hydroxy-2,4,6-trinitro-benzoic acid CAS Name: 3-hydroxy-2,4,6-trinitrobenzoic acid IUPAC Name: 3-hydroxy-2,4,6-trinitrobenzoic acid Traditional Name: 3-hydroxy-2,4,6-trinitro-benzoic acid Formula: C7H3N3O9 MolecularWeight: 273.11342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H3N3O9/c11-6-3(9(16)17)1-2(8(14)15)4(7(12)13)5(6)10(18)19/h1,11H,(H,12,13)