Chem
J-GLOBAL ID:200907022571871525   Nikkaji number:J342.044B

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

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]プロパンアミド
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: C15H18N2O3
Molecular formula furigana: C15-H18-N2-O3
Molecular weight: 274.320
InChI: InChI=1S/C15H18N2O3/c1-4-12(18)17-13-10-7-9(8-16)5-6-11(10)20-15(2,3)14(13)19/h5-7,13-14,19H,4H2,1-3H3,(H,17,18)/t13?,14-/m0/s1
InChI key: HBTPXXIPMVUPPG-KZUDCZAMSA-N
SMILES: CCC(=O)NC1[C@H](O)C(C)(C)Oc2ccc(cc12)C#N
Systematic name  (3):
  • (3S)-4-プロピオニルアミノ-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]プロパンアミド
  • N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]propanamide
Other name (1):
  • (3S)-4-Propionylamino-3,4-dihydro-3β-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-carbonitrile
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