2-(4-fluorophenyl)-3-(furan-2-ylcarbonyl)-5-oxidanylidene-1-(pyridin-1-ium-3-ylmethyl)-2H-pyrrol-4-olate

Systemtic Name: 2-(4-fluorophenyl)-3-(furan-2-ylcarbonyl)-5-oxidanylidene-1-(pyridin-1-ium-3-ylmethyl)-2H-pyrrol-4-olate Openeye Name: 2-(4-fluorophenyl)-3-(furan-2-carbonyl)-5-oxo-1-(pyridin-1-ium-3-ylmethyl)-2H-pyrrol-4-olate CAS Name: 2-(4-fluorophenyl)-3-[2-furanyl(oxo)methyl]-5-oxo-1-(3-pyridin-1-iumylmethyl)-2H-pyrrol-4-olate IUPAC Name: 2-(4-fluorophenyl)-3-(furan-2-carbonyl)-5-oxo-1-(pyridin-1-ium-3-ylmethyl)-2H-pyrrol-4-olate Traditional Name: 5-(4-fluorophenyl)-4-(2-furoyl)-2-keto-1-(pyridin-1-ium-3-ylmethyl)-3-pyrrolin-3-olate Formula: C21H15FN2O4 MolecularWeight: 378.353203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[NH+]=C1)CN2C(C(=C(C2=O)[O-])C(=O)C3=CC=CO3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC(=C[NH+]=C1)CN2C(C(=C(C2=O)[O-])C(=O)C3=CC=CO3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H15FN2O4/c22-15-7-5-14(6-8-15)18-17(19(25)16-4-2-10-28-16)20(26)21(27)24(18)12-13-3-1-9-23-11-13/h1-11,18,26H,12H2