Chem
J-GLOBAL ID:200907016513041873   Nikkaji number:J1.734.286J

(αR,1R,5S)-α-(2-Chlorophenyl)-6-(p-tolylsulfonyl)-6-azabicyclo[3.1.0]hexane-1β-methanol

(αR,1R,5S)-α-(2-クロロフェニル)-6-(p-トリルスルホニル)-6-アザビシクロ[3.1.0]ヘキサン-1β-メタノール
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: C19H20ClNO3S
Molecular formula furigana: C19-H20-CL-N-O3-S
Molecular weight: 377.880
InChI: InChI=1S/C19H20ClNO3S/c1-13-8-10-14(11-9-13)25(23,24)21-17-7-4-12-19(17,21)18(22)15-5-2-3-6-16(15)20/h2-3,5-6,8-11,17-18,22H,4,7,12H2,1H3/t17-,18+,19+,21?/m0/s1
InChI key: QQCNNQDLQXXOSH-BSWYJCKLSA-N
SMILES: Cc1ccc(cc1)S(=O)(=O)N1[C@H]2CCC[C@@]12[C@H](O)c1ccccc1Cl
Systematic name  (3):
  • (αR,1R,5S)-α-(2-クロロフェニル)-6-(p-トリルスルホニル)-6-アザビシクロ[3.1.0]ヘキサン-1β-メタノール
  • (R)-(2-クロロフェニル)[(1R,5S)-6-(4-メチルベンゼンスルホニル)-6-アザビシクロ[3.1.0]ヘキサン-1-イル]メタノール
  • (R)-(2-chlorophenyl)[(1R,5S)-6-(4-methylbenzenesulfonyl)-6-azabicyclo[3.1.0]hexan-1-yl]methanol
Other name (1):
  • (αR,1R,5S)-α-(2-Chlorophenyl)-6-(p-tolylsulfonyl)-6-azabicyclo[3.1.0]hexane-1β-methanol
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