Chem
J-GLOBAL ID：200907001836769097   Nikkaji number：J2.141.707F

(3aS)-2,2-Dimethyl-8β-phenyl-3aα,3bβ,4,7,8,9aα-hexahydro-9H-1,3-dioxa-8a-aza-2H-cyclopenta[a]azulene

(1S,2S,6R,9S)-4,4-ジメチル-9-フェニル-3,5-ジオキサ-8-アザトリシクロ[6.5.0.02,6]トリデカ-11-エン
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： C18H23NO2
Molecular formula furigana： C18-H23-N-O2
Molecular weight： 285.387
InChI： InChI=1S/C18H23NO2/c1-18(2)20-16-12-19-14(13-8-4-3-5-9-13)10-6-7-11-15(19)17(16)21-18/h3-9,14-17H,10-12H2,1-2H3/t14-,15-,16+,17-/m0/s1
InChI key： UBHZKSLRWHIKCK-NXOAAHMSSA-N
SMILES： CC1(C)O[C@@H]2CN3[C@@H](CC=CC[C@H]3c3ccccc3)[C@@H]2O1
Systematic name  (3)：
  • (3aS)-2,2-ジメチル-8β-フェニル-3aα,3bβ,4,7,8,9aα-ヘキサヒドロ-9H-1,3-ジオキサ-8a-アザ-2H-シクロペンタ[a]アズレン
  • (1S,2S,6R,9S)-4,4-ジメチル-9-フェニル-3,5-ジオキサ-8-アザトリシクロ[6.5.0.02,6]トリデカ-11-エン
  • (1S,2S,6R,9S)-4,4-dimethyl-9-phenyl-3,5-dioxa-8-azatricyclo[6.5.0.02,6]tridec-11-ene
Other name (1)：
  • (3aS)-2,2-Dimethyl-8β-phenyl-3aα,3bβ,4,7,8,9aα-hexahydro-9H-1,3-dioxa-8a-aza-2H-cyclopenta[a]azulene
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