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

Systemtic Name: (4E)-5-(3-ethoxy-4-phenylmethoxy-phenyl)-4-[oxidanyl(pyridin-4-yl)methylidene]-1-phenethyl-pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-benzyloxy-3-ethoxy-phenyl)-4-[hydroxy(4-pyridyl)methylene]-1-phenethyl-pyrrolidine-2,3-dione CAS Name: (4E)-5-(3-ethoxy-4-phenylmethoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]-1-phenethylpyrrolidine-2,3-dione IUPAC Name: (4E)-5-(3-ethoxy-4-phenylmethoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]-1-phenethylpyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-benzoxy-3-ethoxy-phenyl)-4-[hydroxy(4-pyridyl)methylene]-1-phenethyl-pyrrolidine-2,3-quinone Formula: C33H30N2O5 MolecularWeight: 534.6017

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(C3=CC=NC=C3)O)C(=O)C(=O)N2CCC4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2/C(=C(/C3=CC=NC=C3)\O)/C(=O)C(=O)N2CCC4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C33H30N2O5/c1-2-39-28-21-26(13-14-27(28)40-22-24-11-7-4-8-12-24)30-29(31(36)25-15-18-34-19-16-25)32(37)33(38)35(30)20-17-23-9-5-3-6-10-23/h3-16,18-19,21,30,36H,2,17,20,22H2,1H3/b31-29+