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CHEBI:120563 - 2-[[1-oxo-2-[3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-1-yl]ethyl]amino]benzoic acid methyl ester

ChEBI IDCHEBI:120563
ChEBI Name2-[[1-oxo-2-[3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-1-yl]ethyl]amino]benzoic acid methyl ester
Stars
DownloadsMolfile
FormulaC17H16F3N3O3
Net Charge0
Average Mass367.327
Monoisotopic Mass367.11438
SMILESCOC(=O)c1ccccc1NC(=O)Cn1nc(C(F)(F)F)c2c1CCC2
InChIInChI=1S/C17H16F3N3O3/c1-26-16(25)10-5-2-3-7-12(10)21-14(24)9-23-13-8-4-6-11(13)15(22-23)17(18,19)20/h2-3,5,7H,4,6,8-9H2,1H3,(H,21,24)
InChIKeyQTVNMBRSHMLISR-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-[[1-oxo-2-[3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-1-yl]ethyl]amino]benzoic acid methyl ester (CHEBI:120563) is a amidobenzoic acid (CHEBI:48470)
Manual XrefsDatabases
LSM-32006LINCS