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CHEBI:83474 - flufenacet OXA

ChEBI IDCHEBI:83474
ChEBI Nameflufenacet OXA
Stars
DefinitionA monocarboxylic acid that is oxoacetic acid substituted by a (4-fluorophenyl)(propan-2-yl)amino group at position 2. It is a metabolite of the herbicide flufenacet.
Last Modified10 November 2014
DownloadsMolfile
FormulaC11H12FNO3
Net Charge0
Average Mass225.219
Monoisotopic Mass225.08012
SMILESCC(C)N(C(=O)C(=O)O)c1ccc(F)cc1
InChIInChI=1S/C11H12FNO3/c1-7(2)13(10(14)11(15)16)9-5-3-8(12)4-6-9/h3-7H,1-2H3,(H,15,16)
InChIKeyFFKNXXCOXIZLJD-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)
flufenacet OXA (CHEBI:83474) is a aromatic amide (CHEBI:62733)
flufenacet OXA (CHEBI:83474) is a monocarboxylic acid (CHEBI:25384)
flufenacet OXA (CHEBI:83474) is a monofluorobenzenes (CHEBI:83575)
IUPAC Name 
[(4-fluorophenyl)(propan-2-yl)amino](oxo)acetic acid