Chem
J-GLOBAL ID：200907074480760283   Nikkaji number：J1.810.790B

3-Phenyl-6,7-diethyl-1,2,3,4,4aα,5,8,8aα-octahydronaphthalene-2,2-dicarbonitrile

3-フェニル-6,7-ジエチル-1,2,3,4,4aα,5,8,8aα-オクタヒドロナフタレン-2,2-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： C22H26N2
Molecular formula furigana： C22-H26-N2
Molecular weight： 318.464
InChI： InChI=1S/C22H26N2/c1-3-16-10-19-12-21(18-8-6-5-7-9-18)22(14-23,15-24)13-20(19)11-17(16)4-2/h5-9,19-21H,3-4,10-13H2,1-2H3/t19-,20+,21?/m1/s1
InChI key： JRFKKBWVSBVIRS-PDYHCXRVSA-N
SMILES： CCC1=C(CC)C[C@H]2CC(C#N)(C#N)C(C[C@H]2C1)c1ccccc1
Systematic name  (3)：
  • 3-フェニル-6,7-ジエチル-1,2,3,4,4aα,5,8,8aα-オクタヒドロナフタレン-2,2-ジカルボニトリル
  • (4aS,8aS)-6,7-ジエチル-3-フェニル-1,2,3,4,4a,5,8,8a-オクタヒドロナフタレン-2,2-ジカルボニトリル
  • (4aS,8aS)-6,7-diethyl-3-phenyl-1,2,3,4,4a,5,8,8a-octahydronaphthalene-2,2-dicarbonitrile
Other name (1)：
  • 3-Phenyl-6,7-diethyl-1,2,3,4,4aα,5,8,8aα-octahydronaphthalene-2,2-dicarbonitrile
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