EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:47429 - 3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE

Default Structure
ChEBI IDCHEBI:47429
ChEBI Name3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE
Stars
Last Modified2 December 2009
DownloadsMolfile
FormulaC12H13ClF3NO
Net Charge0
Average Mass279.689
Monoisotopic Mass279.06378
SMILES[H]c1c([H])c(C(F)(F)F)c([H])c([H])c1N([H])C(=O)C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])Cl
InChIInChI=1S/C12H13ClF3NO/c1-11(2,7-13)10(18)17-9-5-3-8(4-6-9)12(14,15)16/h3-6H,7H2,1-2H3,(H,17,18)
InChIKeyQCQZFHOGRCQNIH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE (CHEBI:47429) is a unclassifieds (CHEBI:27189)
Synonyms  Source
3-chloro-2,2-dimethyl-N-[4-(trifluoromethyl)phenyl]propanamidePDBeChem
3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDEPDBeChem
Manual XrefsDatabases
G1LPDBeChem