Entacapone EP Impurity D

cas: 857629-79-9 — see every product listed under this CAS number, including other names

Entacapone EP Impurity D (CAS 857629-79-9) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-E200314
cas857629-79-9
sizeon request
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properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

3-O-ethylentacapone is a C-nitro compound that is entacapone in which the phenolic hydroxy group that is meta to the nitro group has been converted into the corresponding ethyl ether. It is a nitrile, a monocarboxylic acid amide, an aromatic ether and a member of 2-nitrophenols. It is functionally related to an entacapone and a 5-nitrovanillin.

Source: ChEBI

Identity
Molecular formulaC16H19N3O5
Molecular weight333.34 g/mol
IUPAC name(E)-2-cyano-3-(3-ethoxy-4-hydroxy-5-nitrophenyl)-N,N-diethylprop-2-enamide
InChIKeyFGJZUPPLPIHQSE-KPKJPENVSA-N
SMILESCCN(CC)C(=O)/C(=C/C1=CC(=C(C(=C1)OCC)O)[N+](=O)[O-])/C#N

Computed by PubChem (NCBI)

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