3-(1-benzofuran-2-ylcarbonyl)-2-(3-fluorophenyl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: 3-(1-benzofuran-2-ylcarbonyl)-2-(3-fluorophenyl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 3-(benzofuran-2-carbonyl)-2-(3-fluorophenyl)-4-hydroxy-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-2H-pyrrol-5-one CAS Name: 3-[2-benzofuranyl(oxo)methyl]-2-(3-fluorophenyl)-4-hydroxy-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-2H-pyrrol-5-one IUPAC Name: 3-(1-benzofuran-2-carbonyl)-2-(3-fluorophenyl)-4-hydroxy-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-2H-pyrrol-5-one Traditional Name: 4-(benzofuran-2-carbonyl)-5-(3-fluorophenyl)-3-hydroxy-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-3-pyrrolin-2-one Formula: C25H21FN3O4+ MolecularWeight: 446.450343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)C3=C(C(=O)N(C3C4=CC(=CC=C4)F)CCC[N+]5=CNC=C5)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)C3=C(C(=O)N(C3C4=CC(=CC=C4)F)CCC[N+]5=CNC=C5)O

InChI

InChI=1S/C25H20FN3O4/c26-18-7-3-6-17(13-18)22-21(23(30)20-14-16-5-1-2-8-19(16)33-20)24(31)25(32)29(22)11-4-10-28-12-9-27-15-28/h1-3,5-9,12-15,22H,4,10-11H2,(H,30,31)/p+1