CHEBI:105048 - 1-[4-(2-chlorophenoxy)butyl]imidazole

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-[4-(2-chlorophenoxy)butyl]imidazole
ChEBI ID CHEBI:105048
Definition An aromatic ether that is 2-chlorophenol in which the phenolic hydrogen has been substituted by a 4-(1H-imidazol-1-yl)butyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C13H15ClN2O
Net Charge 0
Average Mass 250.730
Monoisotopic Mass 250.08729
InChI InChI=1S/C13H15ClN2O/c14-12-5-1-2-6-13(12)17-10-4-3-8-16-9-7-15-11-16/h1-2,5-7,9,11H,3-4,8,10H2
InChIKey XOMVWWHMMQAEMP-UHFFFAOYSA-N
SMILES C1=CC=C(C(=C1)OCCCCN2C=CN=C2)Cl
ChEBI Ontology
Outgoing 1-[4-(2-chlorophenoxy)butyl]imidazole (CHEBI:105048) is a aromatic ether (CHEBI:35618)
1-[4-(2-chlorophenoxy)butyl]imidazole (CHEBI:105048) is a imidazoles (CHEBI:24780)
1-[4-(2-chlorophenoxy)butyl]imidazole (CHEBI:105048) is a monochlorobenzenes (CHEBI:83403)
IUPAC Name
1-[4-(2-chlorophenoxy)butyl]-1H-imidazole
Manual Xref Database
LSM-16411 LINCS
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Last Modified
18 October 2019