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CHEBI:48665 - ethyl 2-[5-benzyloxy-4'-(trifluoromethyl)biphenyl-3-yl]pentanoate

ChEBI IDCHEBI:48665
ChEBI Nameethyl 2-[5-benzyloxy-4'-(trifluoromethyl)biphenyl-3-yl]pentanoate
Stars
Last Modified2 March 2015
Submitterhcourrier
DownloadsMolfile
FormulaC27H27F3O3
Net Charge0
Average Mass456.504
Monoisotopic Mass456.19123
SMILESCCCC(C(=O)OCC)c1cc(OCc2ccccc2)cc(-c2ccc(C(F)(F)F)cc2)c1
InChIInChI=1S/C27H27F3O3/c1-3-8-25(26(31)32-4-2)22-15-21(20-11-13-23(14-12-20)27(28,29)30)16-24(17-22)33-18-19-9-6-5-7-10-19/h5-7,9-17,25H,3-4,8,18H2,1-2H3
InChIKeyFPNCIWGMSIVXLX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
ethyl 2-[5-benzyloxy-4'-(trifluoromethyl)biphenyl-3-yl]pentanoate (CHEBI:48665) has part benzyloxy group (CHEBI:48508)
ethyl 2-[5-benzyloxy-4'-(trifluoromethyl)biphenyl-3-yl]pentanoate (CHEBI:48665) is a (trifluoromethyl)benzenes (CHEBI:83565)
ethyl 2-[5-benzyloxy-4'-(trifluoromethyl)biphenyl-3-yl]pentanoate (CHEBI:48665) is a aromatic ether (CHEBI:35618)
ethyl 2-[5-benzyloxy-4'-(trifluoromethyl)biphenyl-3-yl]pentanoate (CHEBI:48665) is a benzyl ether (CHEBI:59859)
ethyl 2-[5-benzyloxy-4'-(trifluoromethyl)biphenyl-3-yl]pentanoate (CHEBI:48665) is a biphenylyl carboxylate ester (CHEBI:48663)
ethyl 2-[5-benzyloxy-4'-(trifluoromethyl)biphenyl-3-yl]pentanoate (CHEBI:48665) is a ethyl ester (CHEBI:23990)
IUPAC Name 
ethyl 2-[5-benzyloxy-4'-(trifluoromethyl)[1,1'-biphenyl]-3-yl]pentanoate
Synonym  Source
2-(5-benzyloxy-4'-trifluoromethyl-biphenyl-3-yl)-pentanoic acid ethyl esterPatent
Manual XrefsDatabases
EP1849762Patent