Chem
J-GLOBAL ID:200907038708838680   Nikkaji number:J342.053A

(3S)-3,4-Dihydro-4-acetylamino-6-chloro-2,2-dimethyl-2H-1-benzopyran-3β-ol

(3S)-3,4-ジヒドロ-4-アセチルアミノ-6-クロロ-2,2-ジメチル-2H-1-ベンゾピラン-3β-オール
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: C13H16ClNO3
Molecular formula furigana: C13-H16-CL-N-O3
Molecular weight: 269.730
InChI: InChI=1S/C13H16ClNO3/c1-7(16)15-11-9-6-8(14)4-5-10(9)18-13(2,3)12(11)17/h4-6,11-12,17H,1-3H3,(H,15,16)/t11?,12-/m0/s1
InChI key: GJBWBLPMRQWGSZ-KIYNQFGBSA-N
SMILES: CC(=O)NC1[C@H](O)C(C)(C)Oc2ccc(Cl)cc12
Systematic name  (3):
  • (3S)-3,4-ジヒドロ-4-アセチルアミノ-6-クロロ-2,2-ジメチル-2H-1-ベンゾピラン-3β-オール
  • N-[(3S)-6-クロロ-3-ヒドロキシ-2,2-ジメチル-3,4-ジヒドロ-2H-1-ベンゾピラン-4-イル]アセトアミド
  • N-[(3S)-6-chloro-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]acetamide
Other name (1):
  • (3S)-3,4-Dihydro-4-acetylamino-6-chloro-2,2-dimethyl-2H-1-benzopyran-3β-ol
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