Chem
J-GLOBAL ID：201607018558998182   Nikkaji number：J3.419.392D

Acetic acid 2-tosyl-5,5-dimethyl-7-butyl-1,2,3,5,6,8aβ-hexahydrocyclohepta[c]pyrrole-4-yl ester

酢酸2-トシル-5,5-ジメチル-7-ブチル-1,2,3,5,6,8aβ-ヘキサヒドロシクロヘプタ[c]ピロール-4-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： C24H33NO4S
Molecular formula furigana： C24-H33-N-O4-S
Molecular weight： 431.590
InChI： InChI=1S/C24H33NO4S/c1-6-7-8-19-13-20-15-25(30(27,28)21-11-9-17(2)10-12-21)16-22(20)23(29-18(3)26)24(4,5)14-19/h9-13,20H,6-8,14-16H2,1-5H3/t20-/m1/s1
InChI key： SRFZSNPHMIETAU-HXUWFJFHSA-N
SMILES： CCCCC1=C[C@@H]2CN(CC2=C(OC(=O)C)C(C)(C)C1)S(=O)(=O)c1ccc(C)cc1
Systematic name  (3)：
  • 酢酸2-トシル-5,5-ジメチル-7-ブチル-1,2,3,5,6,8aβ-ヘキサヒドロシクロヘプタ[c]ピロール-4-イル
  • (8aS)-7-ブチル-5,5-ジメチル-2-(4-メチルベンゼンスルホニル)-1H,2H,3H,5H,6H,8aH-シクロヘプタ[c]ピロール-4-イル アセタート
  • (8aS)-7-butyl-5,5-dimethyl-2-(4-methylbenzenesulfonyl)-1H,2H,3H,5H,6H,8aH-cyclohepta[c]pyrrol-4-yl acetate
Other name (1)：
  • Acetic acid 2-tosyl-5,5-dimethyl-7-butyl-1,2,3,5,6,8aβ-hexahydrocyclohepta[c]pyrrole-4-yl ester
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