Chem
J-GLOBAL ID：200907080709533200   Nikkaji number：J1.948.682F

1-[[(1β,4β)-Bicyclo[2.2.1]hepta-2-ene-6α-yl]carbonyl]-3,5-di-tert-butyl-1H-pyrazole

1-[(1S,2S,4S)-ビシクロ[2.2.1]ヘプタ-5-エン-2-カルボニル]-3,5-ジ-tert-ブチル-1H-ピラゾール
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： C19H28N2O
Molecular formula furigana： C19-H28-N2-O
Molecular weight： 300.446
InChI： InChI=1S/C19H28N2O/c1-18(2,3)15-11-16(19(4,5)6)21(20-15)17(22)14-10-12-7-8-13(14)9-12/h7-8,11-14H,9-10H2,1-6H3/t12-,13+,14-/m0/s1
InChI key： VFIGBQMHMFYRBB-MJBXVCDLSA-N
SMILES： CC(C)(C)c1cc(n(n1)C(=O)[C@H]1C[C@@H]2C[C@H]1C=C2)C(C)(C)C
Systematic name  (4)：
  • 1-[[(1β,4β)-ビシクロ[2.2.1]ヘプタ-2-エン-6α-イル]カルボニル]-3,5-ジ-tert-ブチル-1H-ピラゾール
  • [(1β,4β)-ビシクロ[2.2.1]ヘプタ-2-エン-6α-イル](3,5-ジ-tert-ブチル-1H-ピラゾール-1-イル)ケトン
  • 1-[(1S,2S,4S)-ビシクロ[2.2.1]ヘプタ-5-エン-2-カルボニル]-3,5-ジ-tert-ブチル-1H-ピラゾール
  • 1-[(1S,2S,4S)-bicyclo[2.2.1]hept-5-ene-2-carbonyl]-3,5-di-tert-butyl-1H-pyrazole
Other name (2)：
  • 1-[[(1β,4β)-Bicyclo[2.2.1]hepta-2-ene-6α-yl]carbonyl]-3,5-di-tert-butyl-1H-pyrazole
  • [(1β,4β)-Bicyclo[2.2.1]hepta-2-ene-6α-yl](3,5-di-tert-butyl-1H-pyrazole-1-yl) ketone
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