Chem
J-GLOBAL ID：200907011702284262   Nikkaji number：J1.742.278B

1-Tosyl-2,3,3a,6-tetrahydro-1H-indole-4,5-dicarboxylic acid dimethyl ester

1-トシル-2,3,3a,6-テトラヒドロ-1H-インドール-4,5-ジカルボン酸ジメチル
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： C19H21NO6S
Molecular formula furigana： C19-H21-N-O6-S
Molecular weight： 391.440
InChI： InChI=1S/C19H21NO6S/c1-12-4-6-13(7-5-12)27(23,24)20-11-10-14-16(20)9-8-15(18(21)25-2)17(14)19(22)26-3/h4-7,9,14H,8,10-11H2,1-3H3
InChI key： IJGKINJUAZNOPY-UHFFFAOYSA-N
SMILES： COC(=O)C1=C(C2CCN(C2=CC1)S(=O)(=O)c1ccc(C)cc1)C(=O)OC
Systematic name  (3)：
  • 1-トシル-2,3,3a,6-テトラヒドロ-1H-インドール-4,5-ジカルボン酸ジメチル
  • 4,5-ジメチル 1-(4-メチルベンゼンスルホニル)-2,3,3a,6-テトラヒドロ-1H-インドール-4,5-ジカルボキシラート
  • 4,5-dimethyl 1-(4-methylbenzenesulfonyl)-2,3,3a,6-tetrahydro-1H-indole-4,5-dicarboxylate
Other name (1)：
  • 1-Tosyl-2,3,3a,6-tetrahydro-1H-indole-4,5-dicarboxylic acid dimethyl ester
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