(4E)-4-[(3-methoxyphenyl)-oxidanyl-methylidene]-1-phenethyl-5-pyridin-4-yl-pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[(3-methoxyphenyl)-oxidanyl-methylidene]-1-phenethyl-5-pyridin-4-yl-pyrrolidine-2,3-dione Openeye Name: (4E)-4-[hydroxy-(3-methoxyphenyl)methylene]-1-phenethyl-5-(4-pyridyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[hydroxy-(3-methoxyphenyl)methylidene]-1-phenethyl-5-pyridin-4-ylpyrrolidine-2,3-dione IUPAC Name: (4E)-4-[hydroxy-(3-methoxyphenyl)methylidene]-1-phenethyl-5-pyridin-4-ylpyrrolidine-2,3-dione Traditional Name: (4E)-4-[hydroxy-(3-methoxyphenyl)methylene]-1-phenethyl-5-(4-pyridyl)pyrrolidine-2,3-quinone Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)CCC3=CC=CC=C3)C4=CC=NC=C4)O

Isomeric SMILES

COC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)CCC3=CC=CC=C3)C4=CC=NC=C4)/O

InChI

InChI=1S/C25H22N2O4/c1-31-20-9-5-8-19(16-20)23(28)21-22(18-10-13-26-14-11-18)27(25(30)24(21)29)15-12-17-6-3-2-4-7-17/h2-11,13-14,16,22,28H,12,15H2,1H3/b23-21+