3-(1-benzofuran-2-ylcarbonyl)-2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-1-[3-(dimethylamino)propyl]-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: 3-(1-benzofuran-2-ylcarbonyl)-2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-1-[3-(dimethylamino)propyl]-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 3-(benzofuran-2-carbonyl)-2-(3-bromo-4-hydroxy-5-methoxy-phenyl)-1-[3-(dimethylamino)propyl]-4-hydroxy-2H-pyrrol-5-one CAS Name: 3-[2-benzofuranyl(oxo)methyl]-2-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[3-(dimethylamino)propyl]-4-hydroxy-2H-pyrrol-5-one IUPAC Name: 3-(1-benzofuran-2-carbonyl)-2-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-[3-(dimethylamino)propyl]-4-hydroxy-2H-pyrrol-5-one Traditional Name: 4-(benzofuran-2-carbonyl)-5-(3-bromo-4-hydroxy-5-methoxy-phenyl)-1-[3-(dimethylamino)propyl]-3-hydroxy-3-pyrrolin-2-one Formula: C25H25BrN2O6 MolecularWeight: 529.3798

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C(C(=C(C1=O)O)C(=O)C2=CC3=CC=CC=C3O2)C4=CC(=C(C(=C4)Br)O)OC

Isomeric SMILES

CN(C)CCCN1C(C(=C(C1=O)O)C(=O)C2=CC3=CC=CC=C3O2)C4=CC(=C(C(=C4)Br)O)OC

InChI

InChI=1S/C25H25BrN2O6/c1-27(2)9-6-10-28-21(15-11-16(26)22(29)18(13-15)33-3)20(24(31)25(28)32)23(30)19-12-14-7-4-5-8-17(14)34-19/h4-5,7-8,11-13,21,29,31H,6,9-10H2,1-3H3