Chem
J-GLOBAL ID：200907044563071050   Nikkaji number：J1.166.279J

2,3,3aβ,4,5,7aα-Hexahydro-1H-indene-4β-carboxylic acid 4α-cyclohexylcyclohexane-1α-yl ester

2,3,3aβ,4,5,7aα-ヘキサヒドロ-1H-インデン-4β-カルボン酸4α-シクロヘキシルシクロヘキサン-1α-イル
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： C22H34O2
Molecular formula furigana： C22-H34-O2
Molecular weight： 330.512
InChI： InChI=1S/C22H34O2/c23-22(21-11-5-9-18-8-4-10-20(18)21)24-19-14-12-17(13-15-19)16-6-2-1-3-7-16/h5,9,16-21H,1-4,6-8,10-15H2/t17-,18-,19+,20+,21+/m1/s1
InChI key： GETPEPQUVNWMMH-MJCUULBUSA-N
SMILES： O=C(O[C@H]1CC[C@H](CC1)C1CCCCC1)[C@H]1CC=C[C@H]2CCC[C@H]12
Systematic name  (3)：
  • 2,3,3aβ,4,5,7aα-ヘキサヒドロ-1H-インデン-4β-カルボン酸4α-シクロヘキシルシクロヘキサン-1α-イル
  • (1s,4s)-[1,1'-ビ(シクロヘキサン)]-4-イル (3aS,4S,7aR)-2,3,3a,4,5,7a-ヘキサヒドロ-1H-インデン-4-カルボキシラート
  • (1s,4s)-[1,1'-bi(cyclohexane)]-4-yl (3aS,4S,7aR)-2,3,3a,4,5,7a-hexahydro-1H-indene-4-carboxylate
Other name (1)：
  • 2,3,3aβ,4,5,7aα-Hexahydro-1H-indene-4β-carboxylic acid 4α-cyclohexylcyclohexane-1α-yl ester
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