3-(6-nitro-1-oxidanyl-benzimidazol-2-yl)benzoic acid

Systemtic Name: 3-(6-nitro-1-oxidanyl-benzimidazol-2-yl)benzoic acid Openeye Name: 3-(1-hydroxy-6-nitro-benzimidazol-2-yl)benzoic acid CAS Name: 3-(1-hydroxy-6-nitro-2-benzimidazolyl)benzoic acid IUPAC Name: 3-(1-hydroxy-6-nitrobenzimidazol-2-yl)benzoic acid Traditional Name: 3-(1-hydroxy-6-nitro-benzimidazol-2-yl)benzoic acid Formula: C14H9N3O5 MolecularWeight: 299.23836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C2=NC3=C(N2O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C2=NC3=C(N2O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O5/c18-14(19)9-3-1-2-8(6-9)13-15-11-5-4-10(17(21)22)7-12(11)16(13)20/h1-7,20H,(H,18,19)