[5-(4-bromanyl-6-fluoranyl-7-nitro-1H-benzimidazol-2-yl)furan-2-yl]phosphonic acid

Systemtic Name: [5-(4-bromanyl-6-fluoranyl-7-nitro-1H-benzimidazol-2-yl)furan-2-yl]phosphonic acid Openeye Name: [5-(4-bromo-6-fluoro-7-nitro-1H-benzimidazol-2-yl)-2-furyl]phosphonic acid CAS Name: [5-(4-bromo-6-fluoro-7-nitro-1H-benzimidazol-2-yl)-2-furanyl]phosphonic acid IUPAC Name: [5-(4-bromo-6-fluoro-7-nitro-1H-benzimidazol-2-yl)furan-2-yl]phosphonic acid Traditional Name: [5-(4-bromo-6-fluoro-7-nitro-1H-benzimidazol-2-yl)-2-furyl]phosphonic acid Formula: C11H6BrFN3O6P MolecularWeight: 406.058004

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)P(=O)(O)O)C2=NC3=C(C=C(C(=C3N2)[N+](=O)[O-])F)Br

Isomeric SMILES

C1=C(OC(=C1)P(=O)(O)O)C2=NC3=C(C=C(C(=C3N2)[N+](=O)[O-])F)Br

InChI

InChI=1S/C11H6BrFN3O6P/c12-4-3-5(13)10(16(17)18)9-8(4)14-11(15-9)6-1-2-7(22-6)23(19,20)21/h1-3H,(H,14,15)(H2,19,20,21)