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

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ChEBI Name	1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one

ChEBI ID	CHEBI:83719

ChEBI ASCII Name	1-(4-chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethylbutan-2-one

Definition	A 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.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

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Formula

C15H17ClN2O2

Net Charge

Average Mass

292.761

Monoisotopic Mass

292.09786

InChI

InChI=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

InChIKey

OWEGWHBOCFMBLP-UHFFFAOYSA-N

SMILES

C(C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)Cl)(C)(C)C

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

ChEBI Ontology
Outgoing	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	(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

Last Modified

24 July 2018