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

Systemtic Name: (4E)-1-(3-methoxypropyl)-5-(3-nitrophenyl)-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-4-[hydroxy(4-pyridyl)methylene]-1-(3-methoxypropyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[hydroxy(pyridin-4-yl)methylidene]-1-(3-methoxypropyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[hydroxy(pyridin-4-yl)methylidene]-1-(3-methoxypropyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione Traditional Name: (4E)-4-[hydroxy(4-pyridyl)methylene]-1-(3-methoxypropyl)-5-(3-nitrophenyl)pyrrolidine-2,3-quinone Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(C(=C(C2=CC=NC=C2)O)C(=O)C1=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COCCCN1C(/C(=C(/C2=CC=NC=C2)\O)/C(=O)C1=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O6/c1-29-11-3-10-22-17(14-4-2-5-15(12-14)23(27)28)16(19(25)20(22)26)18(24)13-6-8-21-9-7-13/h2,4-9,12,17,24H,3,10-11H2,1H3/b18-16+