(4E)-4-[(3-methyl-4-phenylmethoxy-phenyl)-oxidanyl-methylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-4-yl-pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[(3-methyl-4-phenylmethoxy-phenyl)-oxidanyl-methylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-4-yl-pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(4-benzyloxy-3-methyl-phenyl)-hydroxy-methylene]-1-(3-morpholinopropyl)-5-(4-pyridyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[hydroxy-(3-methyl-4-phenylmethoxyphenyl)methylidene]-1-[3-(4-morpholinyl)propyl]-5-pyridin-4-ylpyrrolidine-2,3-dione IUPAC Name: (4E)-4-[hydroxy-(3-methyl-4-phenylmethoxyphenyl)methylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-4-ylpyrrolidine-2,3-dione Traditional Name: (4E)-4-[(4-benzoxy-3-methyl-phenyl)-hydroxy-methylene]-1-(3-morpholinopropyl)-5-(4-pyridyl)pyrrolidine-2,3-quinone Formula: C31H33N3O5 MolecularWeight: 527.61082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=NC=C4)O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=NC=C4)/O)OCC5=CC=CC=C5

InChI

InChI=1S/C31H33N3O5/c1-22-20-25(8-9-26(22)39-21-23-6-3-2-4-7-23)29(35)27-28(24-10-12-32-13-11-24)34(31(37)30(27)36)15-5-14-33-16-18-38-19-17-33/h2-4,6-13,20,28,35H,5,14-19,21H2,1H3/b29-27+