3-nitro-5-oxidanylidene-1H-1,2,4-triazole-2-carboxylic acid

Systemtic Name: 3-nitro-5-oxidanylidene-1H-1,2,4-triazole-2-carboxylic acid Openeye Name: 3-nitro-5-oxo-1H-1,2,4-triazole-2-carboxylic acid CAS Name: 3-nitro-5-oxo-1H-1,2,4-triazole-2-carboxylic acid IUPAC Name: 3-nitro-5-oxo-1H-1,2,4-triazole-2-carboxylic acid Traditional Name: 5-keto-3-nitro-1H-1,2,4-triazole-2-carboxylic acid Formula: C3H2N4O5 MolecularWeight: 174.07178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C3H2N4O5/c8-1-4-2(7(11)12)6(5-1)3(9)10/h(H,5,8)(H,9,10)