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CHEBI:113242 - benzoic acid [4-bromo-2-[[[(5-methyl-1H-pyrazol-3-yl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester

Default Structure
ChEBI IDCHEBI:113242
ChEBI Namebenzoic acid [4-bromo-2-[[[(5-methyl-1H-pyrazol-3-yl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester
Stars
DownloadsMolfile
FormulaC19H15BrN4O3
Net Charge0
Average Mass427.258
Monoisotopic Mass426.03275
SMILESCc1cc(C(=O)NN=Cc2cc(Br)ccc2OC(=O)c2ccccc2)nn1
InChIInChI=1S/C19H15BrN4O3/c1-12-9-16(23-22-12)18(25)24-21-11-14-10-15(20)7-8-17(14)27-19(26)13-5-3-2-4-6-13/h2-11H,1H3,(H,22,23)(H,24,25)
InChIKeyKAKKNVZHEPGZPU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
benzoic acid [4-bromo-2-[[[(5-methyl-1H-pyrazol-3-yl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester (CHEBI:113242) is a carbonyl compound (CHEBI:36586)
Manual XrefsDatabases
LSM-24653LINCS