EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:188616 - 2-Chloro-4-(3-pyridinyl)-5,6,7,8-tetrahydro-3-quinolinecarbonitrile

ChEBI IDCHEBI:188616
ChEBI Name2-Chloro-4-(3-pyridinyl)-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H12ClN3
Net Charge0
Average Mass269.735
Monoisotopic Mass269.07198
SMILESN#Cc1c(Cl)nc2c(c1-c1cccnc1)CCCC2
InChIInChI=1S/C15H12ClN3/c16-15-12(8-17)14(10-4-3-7-18-9-10)11-5-1-2-6-13(11)19-15/h3-4,7,9H,1-2,5-6H2
InChIKeyJYRPSSHLWQDHPL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
2-Chloro-4-(3-pyridinyl)-5,6,7,8-tetrahydro-3-quinolinecarbonitrile (CHEBI:188616) is a bipyridines (CHEBI:50511)
IUPAC Name 
2-chloro-4-pyridin-3-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Manual XrefsDatabases
25583365ChemSpider