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CHEBI:83719 - 1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one

ChEBI IDCHEBI:83719
ChEBI Name1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one
Stars
ASCII Name1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one
DefinitionA ketone that is butan-2-one substituted by a 4-chlorophenoxy and a 1H-imidazol-1-yl group at position 1 and 2 methyl groups at position 3.
Last Modified24 July 2018
Submitternamrata
DownloadsMolfile
FormulaC15H17ClN2O2
Net Charge0
Average Mass292.766
Monoisotopic Mass292.09786
SMILESCC(C)(C)C(=O)C(Oc1ccc(Cl)cc1)n1ccnc1
InChIInChI=1S/C15H17ClN2O2/c1-15(2,3)13(19)14(18-9-8-17-10-18)20-12-6-4-11(16)5-7-12/h4-10,14H,1-3H3
InChIKeyOWEGWHBOCFMBLP-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one (CHEBI:83719) is a aromatic ether (CHEBI:35618)
1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one (CHEBI:83719) is a hemiaminal ether (CHEBI:141498)
1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one (CHEBI:83719) is a imidazoles (CHEBI:24780)
1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one (CHEBI:83719) is a ketone (CHEBI:17087)
1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one (CHEBI:83719) is a monochlorobenzenes (CHEBI:83403)
Incoming Relation(s)
(R)-climbazole (CHEBI:83720) is a 1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one (CHEBI:83719)
(S)-climbazole (CHEBI:83722) is a 1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one (CHEBI:83719)
IUPAC Name 
1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one
Manual XrefsDatabases
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