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CHEBI:107899 - 5-methyl-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-(3-nitrophenyl)methyl]-2-phenyl-1H-pyrazol-3-one

ChEBI IDCHEBI:107899
ChEBI Name5-methyl-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-(3-nitrophenyl)methyl]-2-phenyl-1H-pyrazol-3-one
Stars
DownloadsMolfile
FormulaC27H23N5O4
Net Charge0
Average Mass481.512
Monoisotopic Mass481.17500
SMILESCc1nn(-c2ccccc2)c(=O)c1C(c1cccc([N+](=O)[O-])c1)c1c(C)nn(-c2ccccc2)c1=O
InChIInChI=1S/C27H23N5O4/c1-17-23(26(33)30(28-17)20-11-5-3-6-12-20)25(19-10-9-15-22(16-19)32(35)36)24-18(2)29-31(27(24)34)21-13-7-4-8-14-21/h3-16,25,28-29H,1-2H3
InChIKeyCSZZLYHNHCKPJN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-methyl-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-(3-nitrophenyl)methyl]-2-phenyl-1H-pyrazol-3-one (CHEBI:107899) is a pyrazoles (CHEBI:26410)
5-methyl-4-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-(3-nitrophenyl)methyl]-2-phenyl-1H-pyrazol-3-one (CHEBI:107899) is a ring assembly (CHEBI:36820)
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