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CHEBI:107357 - 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(2-methoxyethyl)-2-propenamide

ChEBI IDCHEBI:107357
ChEBI Name3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(2-methoxyethyl)-2-propenamide
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FormulaC14H15BrN2O4
Net Charge0
Average Mass355.188
Monoisotopic Mass354.02152
SMILESCOCCNC(=O)C(C#N)=Cc1cc(Br)c(O)c(OC)c1
InChIInChI=1S/C14H15BrN2O4/c1-20-4-3-17-14(19)10(8-16)5-9-6-11(15)13(18)12(7-9)21-2/h5-7,18H,3-4H2,1-2H3,(H,17,19)
InChIKeyXTLSBBIUZFKKRN-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(2-methoxyethyl)-2-propenamide (CHEBI:107357) is a hydroxycinnamic acid (CHEBI:24689)
Manual XrefsDatabases
LSM-18711LINCS