4-cyclopropyl-2-(5-diethoxyphosphorylfuran-2-yl)-6-fluoranyl-5-(2-methylpropyl)-7-nitro-1H-benzimidazole

Systemtic Name: 4-cyclopropyl-2-(5-diethoxyphosphorylfuran-2-yl)-6-fluoranyl-5-(2-methylpropyl)-7-nitro-1H-benzimidazole Openeye Name: 4-cyclopropyl-2-(5-diethoxyphosphoryl-2-furyl)-6-fluoro-5-isobutyl-7-nitro-1H-benzimidazole CAS Name: 4-cyclopropyl-2-(5-diethoxyphosphoryl-2-furanyl)-6-fluoro-5-(2-methylpropyl)-7-nitro-1H-benzimidazole IUPAC Name: 4-cyclopropyl-2-(5-diethoxyphosphorylfuran-2-yl)-6-fluoro-5-(2-methylpropyl)-7-nitro-1H-benzimidazole Traditional Name: 4-cyclopropyl-2-(5-diethoxyphosphoryl-2-furyl)-6-fluoro-5-isobutyl-7-nitro-1H-benzimidazole Formula: C22H27FN3O6P MolecularWeight: 479.438444

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC=C(O1)C2=NC3=C(N2)C(=C(C(=C3C4CC4)CC(C)C)F)[N+](=O)[O-])OCC

Isomeric SMILES

CCOP(=O)(C1=CC=C(O1)C2=NC3=C(N2)C(=C(C(=C3C4CC4)CC(C)C)F)[N+](=O)[O-])OCC

InChI

InChI=1S/C22H27FN3O6P/c1-5-30-33(29,31-6-2)16-10-9-15(32-16)22-24-19-17(13-7-8-13)14(11-12(3)4)18(23)21(26(27)28)20(19)25-22/h9-10,12-13H,5-8,11H2,1-4H3,(H,24,25)