EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:74235 - isoindolin-1-one

ChEBI IDCHEBI:74235
ChEBI Nameisoindolin-1-one
Stars
DefinitionA member of the class of isoindoles that is 2,3-dihydro-1H-isoindole in which the hydrogens at positon 1 are replaced by an oxo group.
Last Modified20 June 2013
SubmitterGareth Owen
DownloadsMolfile
FormulaC8H7NO
Net Charge0
Average Mass133.150
Monoisotopic Mass133.05276
SMILESO=C1NCc2ccccc21
InChIInChI=1S/C8H7NO/c10-8-7-4-2-1-3-6(7)5-9-8/h1-4H,5H2,(H,9,10)
InChIKeyPXZQEOJJUGGUIB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
isoindolin-1-one (CHEBI:74235) is a isoindoles (CHEBI:24897)
isoindolin-1-one (CHEBI:74235) is a γ-lactam (CHEBI:74222)
IUPAC Name 
isoindolin-1-one
Synonyms  Source
2,3-dihydro-1H-isoindol-1-oneChemIDplus
dihydro-isoindol-1-oneChEBI
1-oxo-isoindolineChEBI
2,3-dihydro-3-oxo-1H-isoindoleChEBI
Registry NumbersSources
Reaxys:115010Reaxys
CAS:480-91-1ChemIDplus