Chem
J-GLOBAL ID：200907083908062330   Nikkaji number：J342.041H

(3S)-4-(N-Acetylisopropylamino)-3,4-dihydro-3β-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-carbonitrile

(3S)-4-(N-アセチルイソプロピルアミノ)-3,4-ジヒドロ-3β-ヒドロキシ-2,2-ジメチル-2H-1-ベンゾピラン-6-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： C17H22N2O3
Molecular formula furigana： C17-H22-N2-O3
Molecular weight： 302.374
InChI： InChI=1S/C17H22N2O3/c1-10(2)19(11(3)20)15-13-8-12(9-18)6-7-14(13)22-17(4,5)16(15)21/h6-8,10,15-16,21H,1-5H3/t15?,16-/m0/s1
InChI key： ICEZUTSSXZBPRR-LYKKTTPLSA-N
SMILES： CC(C)N(C1[C@H](O)C(C)(C)Oc2ccc(cc12)C#N)C(=O)C
Systematic name  (3)：
  • (3S)-4-(N-アセチルイソプロピルアミノ)-3,4-ジヒドロ-3β-ヒドロキシ-2,2-ジメチル-2H-1-ベンゾピラン-6-カルボニトリル
  • N-[(3S)-6-シアノ-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]-N-(プロパン-2-イル)アセトアミド
  • N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-N-(propan-2-yl)acetamide
Other name (1)：
  • (3S)-4-(N-Acetylisopropylamino)-3,4-dihydro-3β-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-carbonitrile
Thsaurus map：
Thesaurus Map

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