(2S)-3-(1-benzofuran-2-ylcarbonyl)-2-(3-hydroxyphenyl)-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: (2S)-3-(1-benzofuran-2-ylcarbonyl)-2-(3-hydroxyphenyl)-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2H-pyrrol-5-one Openeye Name: (2S)-3-(benzofuran-2-carbonyl)-4-hydroxy-2-(3-hydroxyphenyl)-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-5-one CAS Name: (2S)-3-[2-benzofuranyl(oxo)methyl]-4-hydroxy-2-(3-hydroxyphenyl)-1-[2-(4-morpholin-4-iumyl)ethyl]-2H-pyrrol-5-one IUPAC Name: (2S)-3-(1-benzofuran-2-carbonyl)-4-hydroxy-2-(3-hydroxyphenyl)-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-5-one Traditional Name: (5S)-4-(benzofuran-2-carbonyl)-3-hydroxy-5-(3-hydroxyphenyl)-1-(2-morpholin-4-ium-4-ylethyl)-3-pyrrolin-2-one Formula: C25H25N2O6+ MolecularWeight: 449.4758

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C(C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC(=CC=C5)O

Isomeric SMILES

C1COCC[NH+]1CCN2[C@H](C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC(=CC=C5)O

InChI

InChI=1S/C25H24N2O6/c28-18-6-3-5-17(14-18)22-21(23(29)20-15-16-4-1-2-7-19(16)33-20)24(30)25(31)27(22)9-8-26-10-12-32-13-11-26/h1-7,14-15,22,28,30H,8-13H2/p+1/t22-/m0/s1