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CHEBI:194258 - 3-[4-(3,5-dichloro-4-pyridinyl)piperazino]-1,1,1-trifluoro-2-propanol

ChEBI IDCHEBI:194258
ChEBI Name3-[4-(3,5-dichloro-4-pyridinyl)piperazino]-1,1,1-trifluoro-2-propanol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14Cl2F3N3O
Net Charge0
Average Mass344.164
Monoisotopic Mass343.04660
SMILESOC(CN1CCN(c2c(Cl)cncc2Cl)CC1)C(F)(F)F
InChIInChI=1S/C12H14Cl2F3N3O/c13-8-5-18-6-9(14)11(8)20-3-1-19(2-4-20)7-10(21)12(15,16)17/h5-6,10,21H,1-4,7H2
InChIKeyNOYVNTMPAIAKNS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) peripheral blood mononuclear cell (BTO:0001025) MetaboLights (MTBLS6661)
ChEBI Ontology
Outgoing Relation(s)
3-[4-(3,5-dichloro-4-pyridinyl)piperazino]-1,1,1-trifluoro-2-propanol (CHEBI:194258) is a piperazines (CHEBI:26144)
3-[4-(3,5-dichloro-4-pyridinyl)piperazino]-1,1,1-trifluoro-2-propanol (CHEBI:194258) is a pyridines (CHEBI:26421)
IUPAC Name 
3-[4-(3,5-dichloropyridin-4-yl)piperazin-1-yl]-1,1,1-triluoropropan-2-ol
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