2,3,5-trinitro-6-oxidanyl-benzoic acid

Systemtic Name: 2,3,5-trinitro-6-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-3,5,6-trinitro-benzoic acid CAS Name: 2-hydroxy-3,5,6-trinitrobenzoic acid IUPAC Name: 2-hydroxy-3,5,6-trinitrobenzoic acid Traditional Name: 2-hydroxy-3,5,6-trinitro-benzoic acid Formula: C7H3N3O9 MolecularWeight: 273.11342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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