6-nitro-2-oxidanylidene-1,3-dihydrobenzimidazole-5-carboxylic acid

Systemtic Name: 6-nitro-2-oxidanylidene-1,3-dihydrobenzimidazole-5-carboxylic acid Openeye Name: 6-nitro-2-oxo-1,3-dihydrobenzimidazole-5-carboxylic acid CAS Name: 6-nitro-2-oxo-1,3-dihydrobenzimidazole-5-carboxylic acid IUPAC Name: 6-nitro-2-oxo-1,3-dihydrobenzimidazole-5-carboxylic acid Traditional Name: 2-keto-6-nitro-1,3-dihydrobenzimidazole-5-carboxylic acid Formula: C8H5N3O5 MolecularWeight: 223.1424

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC2=C1NC(=O)N2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=C(C(=CC2=C1NC(=O)N2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C8H5N3O5/c12-7(13)3-1-4-5(10-8(14)9-4)2-6(3)11(15)16/h1-2H,(H,12,13)(H2,9,10,14)