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

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3-(furan-2-ylcarbonyl)-4-oxidanyl-1-(pyridin-1-ium-3-ylmethyl)-2H-pyrrol-5-one Openeye Name: 2-(3,4-dimethoxyphenyl)-3-(furan-2-carbonyl)-4-hydroxy-1-(pyridin-1-ium-3-ylmethyl)-2H-pyrrol-5-one CAS Name: 2-(3,4-dimethoxyphenyl)-3-[2-furanyl(oxo)methyl]-4-hydroxy-1-(3-pyridin-1-iumylmethyl)-2H-pyrrol-5-one IUPAC Name: 2-(3,4-dimethoxyphenyl)-3-(furan-2-carbonyl)-4-hydroxy-1-(pyridin-1-ium-3-ylmethyl)-2H-pyrrol-5-one Traditional Name: 5-(3,4-dimethoxyphenyl)-4-(2-furoyl)-3-hydroxy-1-(pyridin-1-ium-3-ylmethyl)-3-pyrrolin-2-one Formula: C23H21N2O6+ MolecularWeight: 421.42264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O6/c1-29-16-8-7-15(11-18(16)30-2)20-19(21(26)17-6-4-10-31-17)22(27)23(28)25(20)13-14-5-3-9-24-12-14/h3-12,20,27H,13H2,1-2H3/p+1