Chem
J-GLOBAL ID:201707008021066641   Nikkaji number:J3.606.268A

2α-Nitro-3β-(4-(tert-butyl)phenyl)-5-phenyl-2,3-dihydrofuran-4-carbonitrile

2α-ニトロ-3β-(4-(tert-ブチル)フェニル)-5-フェニル-2,3-ジヒドロフラン-4-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: C21H20N[N+]O2[O-]
Molecular formula furigana: C21-H20-N2-O3
Molecular weight: 348.402
InChI: InChI=1S/C21H20N2O3/c1-21(2,3)16-11-9-14(10-12-16)18-17(13-22)19(26-20(18)23(24)25)15-7-5-4-6-8-15/h4-12,18,20H,1-3H3/t18-,20-/m0/s1
InChI key: APKKPCCSVVONNJ-ICSRJNTNSA-N
SMILES: CC(C)(C)c1ccc(cc1)[C@@H]1[C@H](OC(=C1C#N)c1ccccc1)[N+](=O)[O-]
Systematic name  (3):
  • 2α-ニトロ-3β-(4-(tert-ブチル)フェニル)-5-フェニル-2,3-ジヒドロフラン-4-カルボニトリル
  • (4S,5S)-4-(4-tert-ブチルフェニル)-5-ニトロ-2-フェニル-4,5-ジヒドロフラン-3-カルボニトリル
  • (4S,5S)-4-(4-tert-butylphenyl)-5-nitro-2-phenyl-4,5-dihydrofuran-3-carbonitrile
Other name (1):
  • 2α-Nitro-3β-(4-(tert-butyl)phenyl)-5-phenyl-2,3-dihydrofuran-4-carbonitrile
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