Chem
J-GLOBAL ID：200907039571234630   Nikkaji number：J342.043D

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

(3S)-4-ホルミルアミノ-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： C13H14N2O3
Molecular formula furigana： C13-H14-N2-O3
Molecular weight： 246.266
InChI： InChI=1S/C13H14N2O3/c1-13(2)12(17)11(15-7-16)9-5-8(6-14)3-4-10(9)18-13/h3-5,7,11-12,17H,1-2H3,(H,15,16)/t11?,12-/m0/s1
InChI key： YKWHCEANORWQRW-KIYNQFGBSA-N
SMILES： CC1(C)Oc2ccc(cc2C(NC=O)[C@@H]1O)C#N
Systematic name  (3)：
  • (3S)-4-ホルミルアミノ-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]ホルムアミド
  • N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]formamide
Other name (1)：
  • (3S)-4-Formylamino-3,4-dihydro-3β-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-carbonitrile
Thsaurus map：
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