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CHEBI:228442 - 3-(2,4-dichloroanilino)-1-(4-methoxyphenyl)prop-2-en-1-one

ChEBI IDCHEBI:228442
ChEBI Name3-(2,4-dichloroanilino)-1-(4-methoxyphenyl)prop-2-en-1-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H13Cl2NO2
Net Charge0
Average Mass322.191
Monoisotopic Mass321.03233
SMILESCOc1ccc(C(=O)C=CNc2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C16H13Cl2NO2/c1-21-13-5-2-11(3-6-13)16(20)8-9-19-15-7-4-12(17)10-14(15)18/h2-10,19H,1H3
InChIKeyJNEGLDKZVIITMM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
3-(2,4-dichloroanilino)-1-(4-methoxyphenyl)prop-2-en-1-one (CHEBI:228442) is a dichlorobenzene (CHEBI:23697)
IUPAC Name 
3-(2,4-dichloroanilino)-1-(4-methoxyphenyl)prop-2-en-1-one
Manual XrefsDatabases
2080709ChemSpider