3-methyl-6-nitro-benzimidazole-5-carboxylic acid

Systemtic Name: 3-methyl-6-nitro-benzimidazole-5-carboxylic acid Openeye Name: 3-methyl-6-nitro-benzimidazole-5-carboxylic acid CAS Name: 3-methyl-6-nitro-5-benzimidazolecarboxylic acid IUPAC Name: 3-methyl-6-nitrobenzimidazole-5-carboxylic acid Traditional Name: 3-methyl-6-nitro-benzimidazole-5-carboxylic acid Formula: C9H7N3O4 MolecularWeight: 221.16958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C=C(C(=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CN1C=NC2=C1C=C(C(=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C9H7N3O4/c1-11-4-10-6-3-7(12(15)16)5(9(13)14)2-8(6)11/h2-4H,1H3,(H,13,14)