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

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ChEBI Name N-benzyl-3-(4-chlorophenyl)-4,5-dihydro-5-isoxazolecarboxamide
ChEBI ID CHEBI:190580
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H15ClN2O2
Net Charge 0
Average Mass 314.770
Monoisotopic Mass 314.08221
InChI InChI=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)
InChIKey IXGHFFIUANXKNX-UHFFFAOYSA-N
SMILES ClC1=CC=C(C2=NOC(C2)C(=O)NCC3=CC=CC=C3)C=C1
Metabolite of Species Details
Rattus norvegicus (NCBI:txid10116) Found in liver (BTO:0000759). See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xref Database
2094236 ChemSpider
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