(4E)-5-(3-bromophenyl)-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-oxidanyl-methylidene]-1-pyridin-2-yl-pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(3-bromophenyl)-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-oxidanyl-methylidene]-1-pyridin-2-yl-pyrrolidine-2,3-dione Openeye Name: (4E)-5-(3-bromophenyl)-4-[hydroxy-(2-methyl-2,3-dihydrobenzofuran-5-yl)methylene]-1-(2-pyridyl)pyrrolidine-2,3-dione CAS Name: (4E)-5-(3-bromophenyl)-4-[hydroxy-(2-methyl-2,3-dihydrobenzofuran-5-yl)methylidene]-1-(2-pyridinyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(3-bromophenyl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-pyridin-2-ylpyrrolidine-2,3-dione Traditional Name: (4E)-5-(3-bromophenyl)-4-[hydroxy-(2-methylcoumaran-5-yl)methylene]-1-(2-pyridyl)pyrrolidine-2,3-quinone Formula: C25H19BrN2O4 MolecularWeight: 491.33336

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=CC=CC=N4)C5=CC(=CC=C5)Br)O

Isomeric SMILES

CC1CC2=C(O1)C=CC(=C2)/C(=C\3/C(N(C(=O)C3=O)C4=CC=CC=N4)C5=CC(=CC=C5)Br)/O

InChI

InChI=1S/C25H19BrN2O4/c1-14-11-17-12-16(8-9-19(17)32-14)23(29)21-22(15-5-4-6-18(26)13-15)28(25(31)24(21)30)20-7-2-3-10-27-20/h2-10,12-14,22,29H,11H2,1H3/b23-21+