Chem
J-GLOBAL ID：200907061737438804   Nikkaji number：J2.706.365I

(3aβ,7aβ)-1-Tosyl-7β-(2,4-dimethoxybenzoyl)octahydro-1H-indole

(3aβ,7aβ)-1-トシル-7β-(2,4-ジメトキシベンゾイル)オクタヒドロ-1H-インドール
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： C24H29NO5S
Molecular formula furigana： C24-H29-N-O5-S
Molecular weight： 443.560
InChI： InChI=1S/C24H29NO5S/c1-16-7-10-19(11-8-16)31(27,28)25-14-13-17-5-4-6-21(23(17)25)24(26)20-12-9-18(29-2)15-22(20)30-3/h7-12,15,17,21,23H,4-6,13-14H2,1-3H3/t17-,21+,23+/m0/s1
InChI key： HPFLCFJTLXTQBH-AMHTUMDSSA-N
SMILES： COc1ccc(C(=O)[C@@H]2CCC[C@H]3CCN([C@@H]23)S(=O)(=O)c2ccc(C)cc2)c(OC)c1
Systematic name  (3)：
  • (3aβ,7aβ)-1-トシル-7β-(2,4-ジメトキシベンゾイル)オクタヒドロ-1H-インドール
  • (3aS,7R,7aR)-7-(2,4-ジメトキシベンゾイル)-1-(4-メチルベンゼンスルホニル)-オクタヒドロ-1H-インドール
  • (3aS,7R,7aR)-7-(2,4-dimethoxybenzoyl)-1-(4-methylbenzenesulfonyl)-octahydro-1H-indole
Other name (1)：
  • (3aβ,7aβ)-1-Tosyl-7β-(2,4-dimethoxybenzoyl)octahydro-1H-indole
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