Chem
J-GLOBAL ID：200907078697200303   Nikkaji number：J1.742.281B

1-Tosyl-1,2,3,4,4a,7-hexahydroquinoline-5,6-dicarboxylic acid dimethyl ester

1-トシル-1,2,3,4,4a,7-ヘキサヒドロキノリン-5,6-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： C20H23NO6S
Molecular formula furigana： C20-H23-N-O6-S
Molecular weight： 405.470
InChI： InChI=1S/C20H23NO6S/c1-13-6-8-14(9-7-13)28(24,25)21-12-4-5-15-17(21)11-10-16(19(22)26-2)18(15)20(23)27-3/h6-9,11,15H,4-5,10,12H2,1-3H3
InChI key： PHNICCKSBNJIKF-UHFFFAOYSA-N
SMILES： COC(=O)C1=C(C2CCCN(C2=CC1)S(=O)(=O)c1ccc(C)cc1)C(=O)OC
Systematic name  (3)：
  • 1-トシル-1,2,3,4,4a,7-ヘキサヒドロキノリン-5,6-ジカルボン酸ジメチル
  • 5,6-ジメチル 1-(4-メチルベンゼンスルホニル)-1,2,3,4,4a,7-ヘキサヒドロキノリン-5,6-ジカルボキシラート
  • 5,6-dimethyl 1-(4-methylbenzenesulfonyl)-1,2,3,4,4a,7-hexahydroquinoline-5,6-dicarboxylate
Other name (1)：
  • 1-Tosyl-1,2,3,4,4a,7-hexahydroquinoline-5,6-dicarboxylic acid dimethyl ester
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