(2S)-3-(1-benzofuran-2-ylcarbonyl)-2-(4-butoxy-3-methoxy-phenyl)-1-(3-morpholin-4-ylpropyl)-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: (2S)-3-(1-benzofuran-2-ylcarbonyl)-2-(4-butoxy-3-methoxy-phenyl)-1-(3-morpholin-4-ylpropyl)-4-oxidanyl-2H-pyrrol-5-one Openeye Name: (2S)-3-(benzofuran-2-carbonyl)-2-(4-butoxy-3-methoxy-phenyl)-4-hydroxy-1-(3-morpholinopropyl)-2H-pyrrol-5-one CAS Name: (2S)-3-[2-benzofuranyl(oxo)methyl]-2-(4-butoxy-3-methoxyphenyl)-4-hydroxy-1-[3-(4-morpholinyl)propyl]-2H-pyrrol-5-one IUPAC Name: (2S)-3-(1-benzofuran-2-carbonyl)-2-(4-butoxy-3-methoxyphenyl)-4-hydroxy-1-(3-morpholin-4-ylpropyl)-2H-pyrrol-5-one Traditional Name: (5S)-4-(benzofuran-2-carbonyl)-5-(4-butoxy-3-methoxy-phenyl)-3-hydroxy-1-(3-morpholinopropyl)-3-pyrrolin-2-one Formula: C31H36N2O7 MolecularWeight: 548.62674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2CCCN3CCOCC3)O)C(=O)C4=CC5=CC=CC=C5O4)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)[C@H]2C(=C(C(=O)N2CCCN3CCOCC3)O)C(=O)C4=CC5=CC=CC=C5O4)OC

InChI

InChI=1S/C31H36N2O7/c1-3-4-16-39-24-11-10-22(20-25(24)37-2)28-27(29(34)26-19-21-8-5-6-9-23(21)40-26)30(35)31(36)33(28)13-7-12-32-14-17-38-18-15-32/h5-6,8-11,19-20,28,35H,3-4,7,12-18H2,1-2H3/t28-/m0/s1