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CHEBI:112931 - 4-[3-(2-chloro-1-oxoethyl)-2,5-dimethyl-1-pyrrolyl]-1,5-dimethyl-2-phenyl-3-pyrazolone

ChEBI IDCHEBI:112931
ChEBI Name4-[3-(2-chloro-1-oxoethyl)-2,5-dimethyl-1-pyrrolyl]-1,5-dimethyl-2-phenyl-3-pyrazolone
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DownloadsMolfile
FormulaC19H20ClN3O2
Net Charge0
Average Mass357.841
Monoisotopic Mass357.12440
SMILESCc1cc(C(=O)CCl)c(C)n1-c1c(C)n(C)n(-c2ccccc2)c1=O
InChIInChI=1S/C19H20ClN3O2/c1-12-10-16(17(24)11-20)13(2)22(12)18-14(3)21(4)23(19(18)25)15-8-6-5-7-9-15/h5-10H,11H2,1-4H3
InChIKeyRGVJYHXOUGSGIM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[3-(2-chloro-1-oxoethyl)-2,5-dimethyl-1-pyrrolyl]-1,5-dimethyl-2-phenyl-3-pyrazolone (CHEBI:112931) is a pyrazoles (CHEBI:26410)
4-[3-(2-chloro-1-oxoethyl)-2,5-dimethyl-1-pyrrolyl]-1,5-dimethyl-2-phenyl-3-pyrazolone (CHEBI:112931) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
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