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CHEBI:18350 - isoquinolin-1(2H)-one

ChEBI IDCHEBI:18350
ChEBI Nameisoquinolin-1(2H)-one
Stars
ASCII Nameisoquinolin-1(2H)-one
Secondary ChEBI IDsCHEBI:471, CHEBI:14478, CHEBI:18848
Last Modified7 July 2015
DownloadsMolfile
FormulaC9H7NO
Net Charge0
Average Mass145.161
Monoisotopic Mass145.05276
SMILESO=c1nccc2ccccc12
InChIInChI=1S/C9H7NO/c11-9-8-4-2-1-3-7(8)5-6-10-9/h1-6H,(H,10,11)
InChIKeyVDBNYAPERZTOOF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
isoquinolin-1(2H)-one (CHEBI:18350) is a isoquinolines (CHEBI:24922)
IUPAC Name 
isoquinolin-1(2H)-one
Synonyms  Source
1(2H)-IsoquinolinoneKEGG COMPOUND
Isoquinolin-1(2H)-oneKEGG COMPOUND
1(2H)-isoquinolinoneChEBI
UniProt Name  Source
isoquinolin-1(2H)-oneUniProt
Manual XrefsDatabases
C06324KEGG COMPOUND
C06324KEGG COMPOUND
Registry NumbersSources
CAS:491-30-5KEGG COMPOUND