4-(4,5-dinitro-1H-benzimidazol-2-yl)benzoic acid

Systemtic Name: 4-(4,5-dinitro-1H-benzimidazol-2-yl)benzoic acid Openeye Name: 4-(4,5-dinitro-1H-benzimidazol-2-yl)benzoic acid CAS Name: 4-(4,5-dinitro-1H-benzimidazol-2-yl)benzoic acid IUPAC Name: 4-(4,5-dinitro-1H-benzimidazol-2-yl)benzoic acid Traditional Name: 4-(4,5-dinitro-1H-benzimidazol-2-yl)benzoic acid Formula: C14H8N4O6 MolecularWeight: 328.23652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(N2)C=CC(=C3[N+](=O)[O-])[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(N2)C=CC(=C3[N+](=O)[O-])[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H8N4O6/c19-14(20)8-3-1-7(2-4-8)13-15-9-5-6-10(17(21)22)12(18(23)24)11(9)16-13/h1-6H,(H,15,16)(H,19,20)