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CHEBI:228745 - N1-[4-(cyanomethyl)phenyl]-4-chlorobenzamide

Default Structure
ChEBI IDCHEBI:228745
ChEBI NameN1-[4-(cyanomethyl)phenyl]-4-chlorobenzamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H11ClN2O
Net Charge0
Average Mass270.719
Monoisotopic Mass270.05599
SMILESN#CCc1ccc(NC(=O)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C15H11ClN2O/c16-13-5-3-12(4-6-13)15(19)18-14-7-1-11(2-8-14)9-10-17/h1-8H,9H2,(H,18,19)
InChIKeyKVAJJPXXNVXJNY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
N1-[4-(cyanomethyl)phenyl]-4-chlorobenzamide (CHEBI:228745) is a nitrile (CHEBI:18379)
IUPAC Name 
4-chloro-N-[4-(cyanomethyl)phenyl]benzamide
Manual XrefsDatabases
587502ChemSpider