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CHEBI:228420 - 4-[4-(trifluoromethoxy)anilino]-2H-1,3-benzoxazin-2-one

ChEBI IDCHEBI:228420
ChEBI Name4-[4-(trifluoromethoxy)anilino]-2H-1,3-benzoxazin-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H9F3N2O3
Net Charge0
Average Mass322.242
Monoisotopic Mass322.05653
SMILESO=c1nc(Nc2ccc(OC(F)(F)F)cc2)c2ccccc2o1
InChIInChI=1S/C15H9F3N2O3/c16-15(17,18)23-10-7-5-9(6-8-10)19-13-11-3-1-2-4-12(11)22-14(21)20-13/h1-8H,(H,19,20,21)
InChIKeyMCWVNVHDUUGAMS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
4-[4-(trifluoromethoxy)anilino]-2H-1,3-benzoxazin-2-one (CHEBI:228420) is a benzoxazine (CHEBI:46969)
IUPAC Name 
4-[4-(triluoromethoxy)anilino]-1,3-benzoxazin-2-one
Manual XrefsDatabases
2014754ChemSpider