Chem
J-GLOBAL ID:200907048117679821   Nikkaji number:J2.180.766D

(3R,8aα)-3β-Phenyl-5-(3-chloropropyl)hexahydro-5H-oxazolo[3,2-a]pyridine-5α-carbonitrile

(3R,8aα)-3β-フェニル-5-(3-クロロプロピル)ヘキサヒドロ-5H-オキサゾロ[3,2-a]ピリジン-5α-カルボニトリル
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: C17H21ClN2O
Molecular formula furigana: C17-H21-CL-N2-O
Molecular weight: 304.820
InChI: InChI=1S/C17H21ClN2O/c18-11-5-10-17(13-19)9-4-8-16-20(17)15(12-21-16)14-6-2-1-3-7-14/h1-3,6-7,15-16H,4-5,8-12H2/t15-,16+,17+/m0/s1
InChI key: ZPXBQLFEHGVDOR-GVDBMIGSSA-N
SMILES: ClCCC[C@]1(CCC[C@H]2OC[C@H](N12)c1ccccc1)C#N
Systematic name  (4):
  • (3R,8aα)-3β-フェニル-5-(3-クロロプロピル)ヘキサヒドロ-5H-オキサゾロ[3,2-a]ピリジン-5α-カルボニトリル
  • 3β-フェニル-5-(3-クロロプロピル)-2,3,6,7,8,8aα-ヘキサヒドロ-5H-オキサゾロ[3,2-a]ピリジン-5α-カルボニトリル
  • (3R,5R,8aR)-5-(3-クロロプロピル)-3-フェニル-ヘキサヒドロ-2H-[1,3]オキサゾロ[3,2-a]ピリジン-5-カルボニトリル
  • (3R,5R,8aR)-5-(3-chloropropyl)-3-phenyl-hexahydro-2H-[1,3]oxazolo[3,2-a]pyridine-5-carbonitrile
Other name (2):
  • (3R,8aα)-3β-Phenyl-5-(3-chloropropyl)hexahydro-5H-oxazolo[3,2-a]pyridine-5α-carbonitrile
  • 3β-Phenyl-5-(3-chloropropyl)-2,3,6,7,8,8aα-hexahydro-5H-oxazolo[3,2-a]pyridine-5α-carbonitrile
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