(4E)-5-(4-butoxy-3-ethoxy-phenyl)-1-(3-imidazol-1-ylpropyl)-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(4-butoxy-3-ethoxy-phenyl)-1-(3-imidazol-1-ylpropyl)-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-butoxy-3-ethoxy-phenyl)-4-[hydroxy(4-pyridyl)methylene]-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione CAS Name: (4E)-5-(4-butoxy-3-ethoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]-1-[3-(1-imidazolyl)propyl]pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(4-butoxy-3-ethoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-butoxy-3-ethoxy-phenyl)-4-[hydroxy(4-pyridyl)methylene]-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-quinone Formula: C28H32N4O5 MolecularWeight: 504.57748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC=NC=C3)O)C(=O)C(=O)N2CCCN4C=CN=C4)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2/C(=C(/C3=CC=NC=C3)\O)/C(=O)C(=O)N2CCCN4C=CN=C4)OCC

InChI

InChI=1S/C28H32N4O5/c1-3-5-17-37-22-8-7-21(18-23(22)36-4-2)25-24(26(33)20-9-11-29-12-10-20)27(34)28(35)32(25)15-6-14-31-16-13-30-19-31/h7-13,16,18-19,25,33H,3-6,14-15,17H2,1-2H3/b26-24+