(E)-3-O-Methyl Entacapone

For research use only. Not for therapeutic Use.

  • CAT Number: R049738
  • CAS Number: 857629-78-8
  • Molecular Formula: C15H17N3O5
  • Molecular Weight: 319.317
  • Purity: ≥95%
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Catalog Number R049738
CAS Number 857629-78-8
Synonyms

(2E)-2-Cyano-N,N-diethyl-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-propenamide; ?Entacapone 3-Methyl Ether;

Molecular Formula C15H17N3O5
Purity ≥95%
Storage Store at RT
IUPAC Name (E)-2-cyano-N,N-diethyl-3-(4-hydroxy-3-methoxy-5-nitrophenyl)prop-2-enamide
InChI InChI=1S/C15H17N3O5/c1-4-17(5-2)15(20)11(9-16)6-10-7-12(18(21)22)14(19)13(8-10)23-3/h6-8,19H,4-5H2,1-3H3/b11-6+
InChIKey MAZRYCCTAIVEQP-IZZDOVSWSA-N
SMILES CCN(CC)C(=O)C(=CC1=CC(=C(C(=C1)OC)O)[N+](=O)[O-])C#N

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