Chem
J-GLOBAL ID：200907014140480100   Nikkaji number：J853.362H

(3aS)-3-Mesityl-3a,4,5,6,7,7aβ-hexahydro-4α,7α-methano-1,2-benzisoxazole

(3aS)-3-メシチル-3a,4,5,6,7,7aβ-ヘキサヒドロ-4α,7α-メタノ-1,2-ベンゾイソオキサゾール
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： C17H21NO
Molecular formula furigana： C17-H21-N-O
Molecular weight： 255.361
InChI： InChI=1S/C17H21NO/c1-9-6-10(2)14(11(3)7-9)16-15-12-4-5-13(8-12)17(15)19-18-16/h6-7,12-13,15,17H,4-5,8H2,1-3H3/t12-,13+,15-,17-/m0/s1
InChI key： WKLZNTYMDOPBSE-YXPYIKCWSA-N
SMILES： Cc1cc(C)c(C2=NO[C@H]3[C@@H]4CC[C@@H](C4)[C@@H]23)c(C)c1
Systematic name  (3)：
  • (3aS)-3-メシチル-3a,4,5,6,7,7aβ-ヘキサヒドロ-4α,7α-メタノ-1,2-ベンゾイソオキサゾール
  • (1R,2S,6S,7S)-5-(2,4,6-トリメチルフェニル)-3-オキサ-4-アザトリシクロ[5.2.1.02,6]デカ-4-エン
  • (1R,2S,6S,7S)-5-(2,4,6-trimethylphenyl)-3-oxa-4-azatricyclo[5.2.1.02,6]dec-4-ene
Other name (1)：
  • (3aS)-3-Mesityl-3a,4,5,6,7,7aβ-hexahydro-4α,7α-methano-1,2-benzisoxazole
Thsaurus map：
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