Chem
J-GLOBAL ID：200907088959095625   Nikkaji number：J847.164I

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

(3S)-2-トシル-5-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： C23H23NO5S
Molecular formula furigana： C23-H23-N-O5-S
Molecular weight： 425.500
InChI： InChI=1S/C23H23NO5S/c1-15-8-10-18(11-9-15)30(27,28)24-14-17-12-21(25)22(16-6-4-3-5-7-16)19(17)13-20(24)23(26)29-2/h3-11,17,20H,12-14H2,1-2H3/t17-,20+/m1/s1
InChI key： WMJAJODMEYSDMR-XLIONFOSSA-N
SMILES： COC(=O)[C@@H]1CC2=C(C(=O)C[C@@H]2CN1S(=O)(=O)c1ccc(C)cc1)c1ccccc1
Systematic name  (3)：
  • (3S)-2-トシル-5-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)-2-(4-メチルベンゼンスルホニル)-6-オキソ-5-フェニル-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)-2-(4-methylbenzenesulfonyl)-6-oxo-5-phenyl-1H,2H,3H,4H,6H,7H,7aH-cyclopenta[c]pyridine-3-carboxylate
Other name (1)：
  • (3S)-2-Tosyl-5-phenyl-6-oxo-2,3,4,6,7,7aβ-hexahydro-1H-2-pyrindine-3α-carboxylic acid methyl ester
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