CHEBI:138203 - N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide

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ChEBI Name N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide
ChEBI ID CHEBI:138203
ChEBI ASCII Name N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide
Definition A monocarboxylic acid amide resulting from the formal condensation of the carboxy group of 2-[4-fluoro-3-(trifluoromethyl)phenoxy]butyric acid with the amino group of benzylamine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C18H17F4NO2
Net Charge 0
Average Mass 355.327
Monoisotopic Mass 355.11954
InChI InChI=1S/C18H17F4NO2/c1-2-16(17(24)23-11-12-6-4-3-5-7-12)25-13-8-9-15(19)14(10-13)18(20,21)22/h3-10,16H,2,11H2,1H3,(H,23,24)
InChIKey FFQPZWRNXKPNPX-UHFFFAOYSA-N
SMILES C(C(CC)OC1=CC(=C(C=C1)F)C(F)(F)F)(NCC2=CC=CC=C2)=O
ChEBI Ontology
Outgoing N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide (CHEBI:138203) has functional parent benzylamine (CHEBI:40538)
N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide (CHEBI:138203) is a (trifluoromethyl)benzenes (CHEBI:83565)
N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide (CHEBI:138203) is a aromatic ether (CHEBI:35618)
N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide (CHEBI:138203) is a monocarboxylic acid amide (CHEBI:29347)
N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide (CHEBI:138203) is a monofluorobenzenes (CHEBI:83575)
Incoming (R)-beflubutamid (CHEBI:138204) is a N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide (CHEBI:138203)
(S)-beflubutamid (CHEBI:138205) is a N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide (CHEBI:138203)
IUPAC Name
N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide
Synonym Source
N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butyramide ChEBI
Manual Xref Database
58 PPDB
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Last Modified
16 August 2017
General Comment
2017-08-16 Note that this is the entry for material with unspecified stereochemistry. There are separate entries for the individual enantiomers [(R)-beflubutamid and (S)-beflubutamid] and for the racemate (beflubutamid).