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CHEBI:107957 - 2-pyridinecarboxylic acid [2-[2-(difluoromethoxy)anilino]-2-oxoethyl] ester

Default Structure
ChEBI IDCHEBI:107957
ChEBI Name2-pyridinecarboxylic acid [2-[2-(difluoromethoxy)anilino]-2-oxoethyl] ester
Stars
DownloadsMolfile
FormulaC15H12F2N2O4
Net Charge0
Average Mass322.267
Monoisotopic Mass322.07651
SMILESO=C(COC(=O)c1ccccn1)Nc1ccccc1OC(F)F
InChIInChI=1S/C15H12F2N2O4/c16-15(17)23-12-7-2-1-5-10(12)19-13(20)9-22-14(21)11-6-3-4-8-18-11/h1-8,15H,9H2,(H,19,20)
InChIKeyQSTDXPKISWJLNS-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)
2-pyridinecarboxylic acid [2-[2-(difluoromethoxy)anilino]-2-oxoethyl] ester (CHEBI:107957) is a aromatic carboxylic acid (CHEBI:33859)
2-pyridinecarboxylic acid [2-[2-(difluoromethoxy)anilino]-2-oxoethyl] ester (CHEBI:107957) is a pyridines (CHEBI:26421)
Manual XrefsDatabases
LSM-19334LINCS