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

Systemtic Name: (2S)-3-(1-benzofuran-2-ylcarbonyl)-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2-thiophen-2-yl-2H-pyrrol-5-one Openeye Name: (2S)-3-(benzofuran-2-carbonyl)-4-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-2-(2-thienyl)-2H-pyrrol-5-one CAS Name: (2S)-3-[2-benzofuranyl(oxo)methyl]-4-hydroxy-1-[2-(4-morpholin-4-iumyl)ethyl]-2-thiophen-2-yl-2H-pyrrol-5-one IUPAC Name: (2S)-3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-2-thiophen-2-yl-2H-pyrrol-5-one Traditional Name: (5S)-4-(benzofuran-2-carbonyl)-3-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-5-(2-thienyl)-3-pyrrolin-2-one Formula: C23H23N2O5S+ MolecularWeight: 439.50412

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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=CS5

Isomeric SMILES

C1COCC[NH+]1CCN2[C@@H](C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC=CS5

InChI

InChI=1S/C23H22N2O5S/c26-21(17-14-15-4-1-2-5-16(15)30-17)19-20(18-6-3-13-31-18)25(23(28)22(19)27)8-7-24-9-11-29-12-10-24/h1-6,13-14,20,27H,7-12H2/p+1/t20-/m1/s1