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

Systemtic Name: 3-(1-benzofuran-2-ylcarbonyl)-2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-4-oxidanyl-1-(pyridin-4-ylmethyl)-2H-pyrrol-5-one Openeye Name: 3-(benzofuran-2-carbonyl)-2-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-hydroxy-1-(4-pyridylmethyl)-2H-pyrrol-5-one CAS Name: 3-[2-benzofuranyl(oxo)methyl]-2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-1-(pyridin-4-ylmethyl)-2H-pyrrol-5-one IUPAC Name: 3-(1-benzofuran-2-carbonyl)-2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-1-(pyridin-4-ylmethyl)-2H-pyrrol-5-one Traditional Name: 4-(benzofuran-2-carbonyl)-5-(3-bromo-4-hydroxy-5-methoxy-phenyl)-3-hydroxy-1-(4-pyridylmethyl)-3-pyrrolin-2-one Formula: C26H19BrN2O6 MolecularWeight: 535.34286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C(=C(C(=O)N2CC3=CC=NC=C3)O)C(=O)C4=CC5=CC=CC=C5O4)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C(=C(C(=O)N2CC3=CC=NC=C3)O)C(=O)C4=CC5=CC=CC=C5O4)Br)O

InChI

InChI=1S/C26H19BrN2O6/c1-34-19-12-16(10-17(27)23(19)30)22-21(24(31)20-11-15-4-2-3-5-18(15)35-20)25(32)26(33)29(22)13-14-6-8-28-9-7-14/h2-12,22,30,32H,13H2,1H3