5-cyano-1-methyl-4-nitro-imidazole-2-carboxylic acid

Systemtic Name: 5-cyano-1-methyl-4-nitro-imidazole-2-carboxylic acid Openeye Name: 5-cyano-1-methyl-4-nitro-imidazole-2-carboxylic acid CAS Name: 5-cyano-1-methyl-4-nitro-2-imidazolecarboxylic acid IUPAC Name: 5-cyano-1-methyl-4-nitroimidazole-2-carboxylic acid Traditional Name: 5-cyano-1-methyl-4-nitro-imidazole-2-carboxylic acid Formula: C6H4N4O4 MolecularWeight: 196.12036

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1C(=O)O)[N+](=O)[O-])C#N

Isomeric SMILES

CN1C(=C(N=C1C(=O)O)[N+](=O)[O-])C#N

InChI

InChI=1S/C6H4N4O4/c1-9-3(2-7)4(10(13)14)8-5(9)6(11)12/h1H3,(H,11,12)