(4E)-4-[1,3-benzodioxol-5-yl(oxidanyl)methylidene]-1-(2-morpholin-4-ylethyl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[1,3-benzodioxol-5-yl(oxidanyl)methylidene]-1-(2-morpholin-4-ylethyl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione Openeye Name: (4E)-4-[1,3-benzodioxol-5-yl(hydroxy)methylene]-1-(2-morpholinoethyl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[1,3-benzodioxol-5-yl(hydroxy)methylidene]-1-[2-(4-morpholinyl)ethyl]-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[1,3-benzodioxol-5-yl(hydroxy)methylidene]-1-(2-morpholin-4-ylethyl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione Traditional Name: (4E)-4-[1,3-benzodioxol-5-yl(hydroxy)methylene]-1-(2-morpholinoethyl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-quinone Formula: C27H30N2O9 MolecularWeight: 526.5351

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2C(=C(C3=CC4=C(C=C3)OCO4)O)C(=O)C(=O)N2CCN5CCOCC5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2/C(=C(/C3=CC4=C(C=C3)OCO4)\O)/C(=O)C(=O)N2CCN5CCOCC5

InChI

InChI=1S/C27H30N2O9/c1-33-20-13-17(14-21(34-2)26(20)35-3)23-22(24(30)16-4-5-18-19(12-16)38-15-37-18)25(31)27(32)29(23)7-6-28-8-10-36-11-9-28/h4-5,12-14,23,30H,6-11,15H2,1-3H3/b24-22+