Chem
J-GLOBAL ID：200907078451940600   Nikkaji number：J1.702.349G

3-[2-(1H-Pyrazole-1-yl)ethyl]-5-methyl-1,2-benzisoxazole

5-メチル-3-[2-(1H-ピラゾール-1-イル)エチル]-1,2-ベンゾオキサゾール
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C13H13N3O
Molecular formula furigana： C13-H13-N3-O
Molecular weight： 227.267
InChI： InChI=1S/C13H13N3O/c1-10-3-4-13-11(9-10)12(15-17-13)5-8-16-7-2-6-14-16/h2-4,6-7,9H,5,8H2,1H3
InChI key： JANCBEBWENNRDA-UHFFFAOYSA-N
SMILES： Cc1ccc2onc(CCn3cccn3)c2c1
Systematic name  (3)：
  • 3-[2-(1H-ピラゾール-1-イル)エチル]-5-メチル-1,2-ベンゾイソオキサゾール
  • 5-メチル-3-[2-(1H-ピラゾール-1-イル)エチル]-1,2-ベンゾオキサゾール
  • 5-methyl-3-[2-(1H-pyrazol-1-yl)ethyl]-1,2-benzoxazole
Other name (1)：
  • 3-[2-(1H-Pyrazole-1-yl)ethyl]-5-methyl-1,2-benzisoxazole
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