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CHEBI:47517 - 4-{4-[4-(3-aminopropoxy)phenyl]-1H-pyrazol-5-yl}-6-chlorobenzene-1,3-diol

Default Structure
ChEBI IDCHEBI:47517
ChEBI Name4-{4-[4-(3-aminopropoxy)phenyl]-1H-pyrazol-5-yl}-6-chlorobenzene-1,3-diol
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DownloadsMolfile
FormulaC18H18ClN3O3
Net Charge0
Average Mass359.813
Monoisotopic Mass359.10367
SMILES[H]Oc1c([H])c(O[H])c(-c2c(-c3c([H])c([H])c(OC([H])([H])C([H])([H])C([H])([H])N([H])[H])c([H])c3[H])c([H])nn2[H])c([H])c1Cl
InChIInChI=1S/C18H18ClN3O3/c19-15-8-13(16(23)9-17(15)24)18-14(10-21-22-18)11-2-4-12(5-3-11)25-7-1-6-20/h2-5,8-10,23-24H,1,6-7,20H2,(H,21,22)
InChIKeyXDDGJOIYZAMLBW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-{4-[4-(3-aminopropoxy)phenyl]-1H-pyrazol-5-yl}-6-chlorobenzene-1,3-diol (CHEBI:47517) is a unclassifieds (CHEBI:27189)
Synonym  Source
4-{4-[4-(3-aminopropoxy)phenyl]-1H-pyrazol-5-yl}-6-chlorobenzene-1,3-diolPDBeChem
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