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CHEBI:43450 - ethyl 4-{2-[1-(6-methylpyridazin-3-yl)piperidin-4-yl]ethoxy}benzoate

ChEBI IDCHEBI:43450
ChEBI Nameethyl 4-{2-[1-(6-methylpyridazin-3-yl)piperidin-4-yl]ethoxy}benzoate
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Last Modified17 October 2009
DownloadsMolfile
FormulaC21H27N3O3
Net Charge0
Average Mass369.465
Monoisotopic Mass369.20524
SMILES[H]c1c(N2C([H])([H])C([H])([H])C([H])(C([H])([H])C([H])([H])Oc3c([H])c([H])c(C(=O)OC([H])([H])C([H])([H])[H])c([H])c3[H])C([H])([H])C2([H])[H])nnc(C([H])([H])[H])c1[H]
InChIInChI=1S/C21H27N3O3/c1-3-26-21(25)18-5-7-19(8-6-18)27-15-12-17-10-13-24(14-11-17)20-9-4-16(2)22-23-20/h4-9,17H,3,10-15H2,1-2H3
InChIKeyKCHIOGFOPPOUJC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
ethyl 4-{2-[1-(6-methylpyridazin-3-yl)piperidin-4-yl]ethoxy}benzoate (CHEBI:43450) is a benzoate ester (CHEBI:36054)
ethyl 4-{2-[1-(6-methylpyridazin-3-yl)piperidin-4-yl]ethoxy}benzoate (CHEBI:43450) is a pyridazinylpiperidine (CHEBI:48586)
Synonyms  Source
(METHYLPYRIDAZINE PIPERIDINE ETHYLOXYPHENYL)ETHYLACETATEPDBeChem
ethyl 4-{2-[1-(6-methylpyridazin-3-yl)piperidin-4-yl]ethoxy}benzoatePDBeChem
Manual XrefsDatabases
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