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CHEBI:109715 - 1-benzoyl-5-hydroxy-5-(4-methylphenyl)-4H-pyrazole-3-carboxylic acid ethyl ester

ChEBI IDCHEBI:109715
ChEBI Name1-benzoyl-5-hydroxy-5-(4-methylphenyl)-4H-pyrazole-3-carboxylic acid ethyl ester
Stars
DownloadsMolfile
FormulaC20H20N2O4
Net Charge0
Average Mass352.390
Monoisotopic Mass352.14231
SMILESCCOC(=O)C1=NN(C(=O)c2ccccc2)C(O)(c2ccc(C)cc2)C1
InChIInChI=1S/C20H20N2O4/c1-3-26-19(24)17-13-20(25,16-11-9-14(2)10-12-16)22(21-17)18(23)15-7-5-4-6-8-15/h4-12,25H,3,13H2,1-2H3
InChIKeyABQRHGHOVQWKHE-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)
1-benzoyl-5-hydroxy-5-(4-methylphenyl)-4H-pyrazole-3-carboxylic acid ethyl ester (CHEBI:109715) is a benzoic acids (CHEBI:22723)
Manual XrefsDatabases
LSM-21143LINCS