Chemical Compound

Opicapone Impurity 42

Opicapone Impurity 42 chemical structure
Primary Record

Opicapone Impurity 42

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
176480928
SMILES
CC1=C(C(=[N+](C(=C1Cl)C)[O-])Cl)/C(=N/OC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])/NC(=O)C3=CC(=C(C(=C3)O)O)[N+](=O)[O-]
Canonical SMILES
Cc1c(Cl)c(C)[n+]([O-])c(Cl)c1/C(=N/OC(=O)c1cc(O)c(O)c([N+](=O)[O-])c1)NC(=O)c1cc(O)c(O)c([N+](=O)[O-])c1

Names & Synonyms

  • Opicapone Impurity 42
  • Entacapone impurity 44
  • (Z)-2,5-dichloro-3-(N-(3,4-dihydroxy-5-nitrobenzoyl)-N'-((3,4-dihydroxy-5-nitrobenzoyl)oxy)carbamimidoyl)-4,6-dimethylpyridine 1-oxide