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CHEBI:104235 - 2-(4-chlorophenoxy)butanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester

ChEBI IDCHEBI:104235
ChEBI Name2-(4-chlorophenoxy)butanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester
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FormulaC18H24ClNO3
Net Charge0
Average Mass337.847
Monoisotopic Mass337.14447
SMILESCCC(Oc1ccc(Cl)cc1)C(=O)OC1CC2CCC(C1)N2C
InChIInChI=1S/C18H24ClNO3/c1-3-17(22-15-8-4-12(19)5-9-15)18(21)23-16-10-13-6-7-14(11-16)20(13)2/h4-5,8-9,13-14,16-17H,3,6-7,10-11H2,1-2H3
InChIKeyWTPAXDRULIZRDJ-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-(4-chlorophenoxy)butanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester (CHEBI:104235) is a monocarboxylic acid (CHEBI:25384)
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