Chem
J-GLOBAL ID：200907051040460164   Nikkaji number：J847.167C

(3S)-2-Tosyl-5-[4-(methoxycarbonyl)phenyl]-6-oxo-2,3,4,6,7,7aβ-hexahydro-1H-2-pyrindine-3α-carboxylic acid methyl ester

(3S)-2-トシル-5-[4-(メトキシカルボニル)フェニル]-6-オキソ-2,3,4,6,7,7aβ-ヘキサヒドロ-1H-2-ピリンジン-3α-カルボン酸メチル
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： C25H25NO7S
Molecular formula furigana： C25-H25-N-O7-S
Molecular weight： 483.540
InChI： InChI=1S/C25H25NO7S/c1-15-4-10-19(11-5-15)34(30,31)26-14-18-12-22(27)23(20(18)13-21(26)25(29)33-3)16-6-8-17(9-7-16)24(28)32-2/h4-11,18,21H,12-14H2,1-3H3/t18-,21+/m1/s1
InChI key： PTIKPIWDDDOHAR-NQIIRXRSSA-N
SMILES： COC(=O)[C@@H]1CC2=C(C(=O)C[C@@H]2CN1S(=O)(=O)c1ccc(C)cc1)c1ccc(cc1)C(=O)OC
Systematic name  (3)：
  • (3S)-2-トシル-5-[4-(メトキシカルボニル)フェニル]-6-オキソ-2,3,4,6,7,7aβ-ヘキサヒドロ-1H-2-ピリンジン-3α-カルボン酸メチル
  • メチル (3S,7aS)-5-[4-(メトキシカルボニル)フェニル]-2-(4-メチルベンゼンスルホニル)-6-オキソ-1H,2H,3H,4H,6H,7H,7aH-シクロペンタ[c]ピリジン-3-カルボキシラート
  • methyl (3S,7aS)-5-[4-(methoxycarbonyl)phenyl]-2-(4-methylbenzenesulfonyl)-6-oxo-1H,2H,3H,4H,6H,7H,7aH-cyclopenta[c]pyridine-3-carboxylate
Other name (1)：
  • (3S)-2-Tosyl-5-[4-(methoxycarbonyl)phenyl]-6-oxo-2,3,4,6,7,7aβ-hexahydro-1H-2-pyrindine-3α-carboxylic acid methyl ester
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