EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:94598 - 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-(4-chlorophenoxy)ethanone

ChEBI IDCHEBI:94598
ChEBI Name1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-(4-chlorophenoxy)ethanone
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC20H21ClN2O4
Net Charge0
Average Mass388.851
Monoisotopic Mass388.11898
SMILESO=C(COc1ccc(Cl)cc1)N1CCN(Cc2ccc3c(c2)OCO3)CC1
InChIInChI=1S/C20H21ClN2O4/c21-16-2-4-17(5-3-16)25-13-20(24)23-9-7-22(8-10-23)12-15-1-6-18-19(11-15)27-14-26-18/h1-6,11H,7-10,12-14H2
InChIKeyBFUJHVVEMMWLHC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-(4-chlorophenoxy)ethanone (CHEBI:94598) is a benzodioxoles (CHEBI:38298)
Synonyms  Source
fipexide HClDrugCentral
fipexide hydrochlorideDrugCentral
p-ChlorophenoxyacetylpiperonylpiperazideDrugCentral
Manual XrefsDatabases
1172DrugCentral
LSM-5507LINCS
Registry NumbersSources
CAS:34161-24-5DrugCentral