2-(1-methyl-5-nitro-imidazol-2-yl)-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-(1-methyl-5-nitro-imidazol-2-yl)-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-(1-methyl-5-nitro-imidazol-2-yl)-3H-benzimidazole-5-carboxylic acid CAS Name: 2-(1-methyl-5-nitro-2-imidazolyl)-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-(1-methyl-5-nitroimidazol-2-yl)-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-(1-methyl-5-nitro-imidazol-2-yl)-3H-benzimidazole-5-carboxylic acid Formula: C12H9N5O4 MolecularWeight: 287.23096

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C2=NC3=C(N2)C=C(C=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1C2=NC3=C(N2)C=C(C=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O4/c1-16-9(17(20)21)5-13-11(16)10-14-7-3-2-6(12(18)19)4-8(7)15-10/h2-5H,1H3,(H,14,15)(H,18,19)