Molecular properties
- Formula
- C14H15N3O5
- Molar mass
- 305.29 g·mol−1
- Exact mass
- 305.1012 Da
- 9
- PubChem CID
- 5281081
Molecule record
(E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-N,N-diethylprop-2-enamide
C14H15N3O5
305.29 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Alkene
Amide
Aromatic ring
Nitrile
Nitro compound
Phenol
Tertiary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- (2E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-N,N-diethylprop-2-enamide
- (E)-2-cyano-3-(3,4-dihydroxy-5-nitro-phenyl)-N,N-diethyl-prop-2-enamide
- (E)-Entacapone
- (E)-alpha-Cyano-N,N-diethyl-3,4-dihydroxy-5-nitrocinnamamide
- 130929-57-6
- 2-Cyano-N,N-diethyl-3-(3,4-dihydroxy-5-nitrophenyl)propenamide
- 2-Propenamide, 2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-N,N-diethyl-, (2E)-
- 4975G9NM6T
Show all 24 synonyms
- CHEBI:4798
- CORBILTA COMPONENT ENTACAPONE
- Comtan
- Comtess
- DTXCID3026439
- DTXSID5046439
- ENTACAPONE
- Entacapona
- Entacapone orion
- Entacapone teva
- Entacaponum
- LEVODOPA/CARBIDOPA/ENTACAPONE ORION COMPONENT ENTACAPONE
- N,N-diethyl-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl) acrylamide
- OR-611
- RefChem:56991
- STALEVO COMPONENT ENTACAPONE
Structure identifiers
- Canonical SMILES
- CCN(CC)C(=O)/C(C#N)=C/c1cc(O)c(O)c([N+](=O)[O-])c1
- Isomeric SMILES
- CCN(CC)C(=O)/C(=C/C1=CC(=C(C(=C1)O)O)[N+](=O)[O-])/C#N
- InChI
- InChI=1S/C14H15N3O5/c1-3-16(4-2)14(20)10(8-15)5-9-6-11(17(21)22)13(19)12(18)7-9/h5-7,18-19H,3-4H2,1-2H3/b10-5+
- InChIKey
- JRURYQJSLYLRLN-BJMVGYQFSA-N
- PubChem CID
- 5281081
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for (E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-N,N-diethylprop-2-enamide; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for (E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-N,N-diethylprop-2-enamide; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.