Chem
J-GLOBAL ID：200907047520412693   Nikkaji number：J1.175.729D

(1S)-1,4aβ-Dimethyl-2β-(chloromethylsulfonyloxy)-5-oxo-1,2,3,4,4a,5,6,7-octahydronaphthalene-1α-acetonitrile

(1S)-1,4aβ-ジメチル-2β-(クロロメチルスルホニルオキシ)-5-オキソ-1,2,3,4,4a,5,6,7-オクタヒドロナフタレン-1α-アセトニトリル
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： C15H20ClNO4S
Molecular formula furigana： C15-H20-CL-N-O4-S
Molecular weight： 345.840
InChI： InChI=1S/C15H20ClNO4S/c1-14-7-6-13(21-22(19,20)10-16)15(2,8-9-17)11(14)4-3-5-12(14)18/h4,13H,3,5-8,10H2,1-2H3/t13-,14-,15-/m0/s1
InChI key： JLTRSGCDQSOGKB-KKUMJFAQSA-N
SMILES： C[C@@]1(CC#N)[C@H](CC[C@]2(C)C(=O)CCC=C12)OS(=O)(=O)CCl
Systematic name  (3)：
  • (1S)-1,4aβ-ジメチル-2β-(クロロメチルスルホニルオキシ)-5-オキソ-1,2,3,4,4a,5,6,7-オクタヒドロナフタレン-1α-アセトニトリル
  • (1S,2S,4aS)-1-(シアノメチル)-1,4a-ジメチル-5-オキソ-1,2,3,4,4a,5,6,7-オクタヒドロナフタレン-2-イル クロロメタンスルホナート
  • (1S,2S,4aS)-1-(cyanomethyl)-1,4a-dimethyl-5-oxo-1,2,3,4,4a,5,6,7-octahydronaphthalen-2-yl chloromethanesulfonate
Other name (1)：
  • (1S)-1,4aβ-Dimethyl-2β-(chloromethylsulfonyloxy)-5-oxo-1,2,3,4,4a,5,6,7-octahydronaphthalene-1α-acetonitrile
Thsaurus map：
Thesaurus Map

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