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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > n-(3-acetylphenyl)-3-(1-ethyl-3-methyl-4-pyrazolyl)-4,5-dihydroisoxazole-5-carboxamide

Preferred term

n-(3-acetylphenyl)-3-(1-ethyl-3-methyl-4-pyrazolyl)-4,5-dihydroisoxazole-5-carboxamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C18H20N4O3

inchi

  • InChI=1S/C18H20N4O3/c1-4-22-10-15(11(2)20-22)16-9-17(25-21-16)18(24)19-14-7-5-6-13(8-14)12(3)23/h5-8,10,17H,4,9H2,1-3H3,(H,19,24)

inchikey

  • ZSPSZLNZRNRKAI-UHFFFAOYSA-N

mass

  • 340.377

monoisotopicmass

  • 340.15354

smiles

  • CCN1C=C(C(=N1)C)C2=NOC(C2)C(=O)NC3=CC=CC(=C3)C(=O)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:116819

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