Chem
J-GLOBAL ID:200907006949906564   Nikkaji number:J1.568.803C

(1α,4α)-5,7-(1,4-Phenylenebistrimethylene)bicyclo[2.2.2]octa-2,5,7-triene-2,3-dicarbonitrile

(1α,4α)-5,7-(1,4-フェニレンビストリメチレン)ビシクロ[2.2.2]オクタ-2,5,7-トリエン-2,3-ジカルボニトリル
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: C22H20N2
Molecular formula furigana: C22-H20-N2
Molecular weight: 312.416
InChI: InChI=1S/C22H20N2/c23-13-21-19-12-18-6-2-4-16-9-7-15(8-10-16)3-1-5-17(19)11-20(18)22(21)14-24/h7-12,19-20H,1-6H2/t19-,20-/m1/s1
InChI key: QTWWZXBFZQROES-WOJBJXKFSA-N
SMILES: N#CC1=C(C#N)[C@@H]2C=C3CCCc4ccc(CCCC2=C[C@@H]13)cc4
Systematic name  (4):
  • (6R,17R)-6,17-エテノトリシクロ[10.2.2.25,8]オクタデカ-5(18),7,12,14(1),15-ペンタエン-19,20-ジカルボニトリル
  • (1α,4α)-5,7-(1,4-フェニレンビストリメチレン)ビシクロ[2.2.2]オクタ-2,5,7-トリエン-2,3-ジカルボニトリル
  • (7R,10R)-テトラシクロ[14.2.2.05,10.07,12]イコサ-1(18),5,8,11,16,19-ヘキサエン-8,9-ジカルボニトリル
  • (7R,10R)-tetracyclo[14.2.2.05,10.07,12]icosa-1(18),5,8,11,16,19-hexaene-8,9-dicarbonitrile
Other name (2):
  • (6R,17R)-6,17-Ethenotricyclo[10.2.2.25,8]octadeca-5(18),7,12,14(1),15-pentene-19,20-dicarbonitrile
  • (1α,4α)-5,7-(1,4-Phenylenebistrimethylene)bicyclo[2.2.2]octa-2,5,7-triene-2,3-dicarbonitrile
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