1H-imidazole; 3-methyl-5-nitro-imidazole-4-carboxylic acid

Systemtic Name: 1H-imidazole; 3-methyl-5-nitro-imidazole-4-carboxylic acid Openeye Name: imidazole; 3-methyl-5-nitro-imidazole-4-carboxylic acid CAS Name: 1H-imidazole; 3-methyl-5-nitro-4-imidazolecarboxylic acid IUPAC Name: 1H-imidazole; 3-methyl-5-nitroimidazole-4-carboxylic acid Traditional Name: glyoxaline; 3-methyl-5-nitro-imidazole-4-carboxylic acid Formula: C8H9N5O4 MolecularWeight: 239.18816

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1C(=O)O)[N+](=O)[O-].C1=CN=CN1

Isomeric SMILES

CN1C=NC(=C1C(=O)O)[N+](=O)[O-].C1=CN=CN1

InChI

InChI=1S/C5H5N3O4.C3H4N2/c1-7-2-6-4(8(11)12)3(7)5(9)10;1-2-5-3-4-1/h2H,1H3,(H,9,10);1-3H,(H,4,5)