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CHEBI:190580 - N-benzyl-3-(4-chlorophenyl)-4,5-dihydro-5-isoxazolecarboxamide

ChEBI IDCHEBI:190580
ChEBI NameN-benzyl-3-(4-chlorophenyl)-4,5-dihydro-5-isoxazolecarboxamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H15ClN2O2
Net Charge0
Average Mass314.772
Monoisotopic Mass314.08221
SMILESO=C(NCc1ccccc1)C1CC(c2ccc(Cl)cc2)=NO1
InChIInChI=1S/C17H15ClN2O2/c18-14-8-6-13(7-9-14)15-10-16(22-20-15)17(21)19-11-12-4-2-1-3-5-12/h1-9,16H,10-11H2,(H,19,21)
InChIKeyIXGHFFIUANXKNX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) liver (BTO:0000759) MetaboLights (MTBLS4163)
ChEBI Ontology
Outgoing Relation(s)
N-benzyl-3-(4-chlorophenyl)-4,5-dihydro-5-isoxazolecarboxamide (CHEBI:190580) is a organochlorine compound (CHEBI:36683)
IUPAC Name 
N-benzyl-3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Manual XrefsDatabases
2094236ChemSpider