EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:107479 - 1-azepanecarboxylic acid (7-chloro-4-quinolinyl) ester

ChEBI IDCHEBI:107479
ChEBI Name1-azepanecarboxylic acid (7-chloro-4-quinolinyl) ester
Stars
DownloadsMolfile
FormulaC16H17ClN2O2
Net Charge0
Average Mass304.777
Monoisotopic Mass304.09786
SMILESO=C(Oc1ccnc2cc(Cl)ccc12)N1CCCCCC1
InChIInChI=1S/C16H17ClN2O2/c17-12-5-6-13-14(11-12)18-8-7-15(13)21-16(20)19-9-3-1-2-4-10-19/h5-8,11H,1-4,9-10H2
InChIKeyQBGNBCNFOZTKHI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-azepanecarboxylic acid (7-chloro-4-quinolinyl) ester (CHEBI:107479) is a organochlorine compound (CHEBI:36683)
1-azepanecarboxylic acid (7-chloro-4-quinolinyl) ester (CHEBI:107479) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-18834LINCS