1,4,5-trinitroimidazole-2-carboxylic acid

Systemtic Name: 1,4,5-trinitroimidazole-2-carboxylic acid Openeye Name: 1,4,5-trinitroimidazole-2-carboxylic acid CAS Name: 1,4,5-trinitro-2-imidazolecarboxylic acid IUPAC Name: 1,4,5-trinitroimidazole-2-carboxylic acid Traditional Name: 1,4,5-trinitroimidazole-2-carboxylic acid Formula: C4HN5O8 MolecularWeight: 247.07944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1(=C(N(C(=N1)C(=O)O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1(=C(N(C(=N1)C(=O)O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C4HN5O8/c10-4(11)2-5-1(7(12)13)3(8(14)15)6(2)9(16)17/h(H,10,11)