2-[3-(1-benzofuran-2-ylcarbonyl)-2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-(1-benzofuran-2-ylcarbonyl)-2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[3-(benzofuran-2-carbonyl)-2-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[3-[2-benzofuranyl(oxo)methyl]-2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]ethyl-dimethylammonium IUPAC Name: 2-[3-(1-benzofuran-2-carbonyl)-2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]ethyl-dimethylazanium Traditional Name: 2-[3-(benzofuran-2-carbonyl)-2-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]ethyl-dimethyl-ammonium Formula: C24H24BrN2O6+ MolecularWeight: 516.36116

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C(C(=C(C1=O)O)C(=O)C2=CC3=CC=CC=C3O2)C4=CC(=C(C(=C4)Br)O)OC

Isomeric SMILES

C[NH+](C)CCN1C(C(=C(C1=O)O)C(=O)C2=CC3=CC=CC=C3O2)C4=CC(=C(C(=C4)Br)O)OC

InChI

InChI=1S/C24H23BrN2O6/c1-26(2)8-9-27-20(14-10-15(25)21(28)17(12-14)32-3)19(23(30)24(27)31)22(29)18-11-13-6-4-5-7-16(13)33-18/h4-7,10-12,20,28,30H,8-9H2,1-3H3/p+1