3-(furan-2-ylcarbonyl)-2-(3-methoxy-4-oxidanyl-phenyl)-4-oxidanyl-1-(pyridin-1-ium-3-ylmethyl)-2H-pyrrol-5-one

Systemtic Name: 3-(furan-2-ylcarbonyl)-2-(3-methoxy-4-oxidanyl-phenyl)-4-oxidanyl-1-(pyridin-1-ium-3-ylmethyl)-2H-pyrrol-5-one Openeye Name: 3-(furan-2-carbonyl)-4-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-1-(pyridin-1-ium-3-ylmethyl)-2H-pyrrol-5-one CAS Name: 3-[2-furanyl(oxo)methyl]-4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(3-pyridin-1-iumylmethyl)-2H-pyrrol-5-one IUPAC Name: 3-(furan-2-carbonyl)-4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(pyridin-1-ium-3-ylmethyl)-2H-pyrrol-5-one Traditional Name: 4-(2-furoyl)-3-hydroxy-5-(4-hydroxy-3-methoxy-phenyl)-1-(pyridin-1-ium-3-ylmethyl)-3-pyrrolin-2-one Formula: C22H19N2O6+ MolecularWeight: 407.39606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(=C(C(=O)N2CC3=C[NH+]=CC=C3)O)C(=O)C4=CC=CO4)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(=C(C(=O)N2CC3=C[NH+]=CC=C3)O)C(=O)C4=CC=CO4)O

InChI

InChI=1S/C22H18N2O6/c1-29-17-10-14(6-7-15(17)25)19-18(20(26)16-5-3-9-30-16)21(27)22(28)24(19)12-13-4-2-8-23-11-13/h2-11,19,25,27H,12H2,1H3/p+1