2-(3-fluoranyl-4-nitro-phenyl)-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-(3-fluoranyl-4-nitro-phenyl)-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-(3-fluoro-4-nitro-phenyl)-3H-benzimidazole-5-carboxylic acid CAS Name: 2-(3-fluoro-4-nitrophenyl)-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-(3-fluoro-4-nitrophenyl)-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-(3-fluoro-4-nitro-phenyl)-3H-benzimidazole-5-carboxylic acid Formula: C14H8FN3O4 MolecularWeight: 301.229423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8FN3O4/c15-9-5-7(2-4-12(9)18(21)22)13-16-10-3-1-8(14(19)20)6-11(10)17-13/h1-6H,(H,16,17)(H,19,20)