Chem
J-GLOBAL ID：200907035023098251   Nikkaji number：J733.352H

(4S,6S)-3-Tosyl-8-oxo-9-phenyl-3-azabicyclo[4.3.0]non-9(1)-ene-4α-carboxylic acid methyl ester

(4S,6S)-3-トシル-8-オキソ-9-フェニル-3-アザビシクロ[4.3.0]ノナ-9(1)-エン-4α-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)24-14-19-17(12-20(24)23(26)29-2)13-21(25)22(19)16-6-4-3-5-7-16/h3-11,17,20H,12-14H2,1-2H3/t17-,20-/m0/s1
InChI key： GLLAEAYTKDCAOP-PXNSSMCTSA-N
SMILES： COC(=O)[C@@H]1C[C@H]2CC(=O)C(=C2CN1S(=O)(=O)c1ccc(C)cc1)c1ccccc1
Systematic name  (4)：
  • (3S)-2-トシル-6-オキソ-7-フェニル-2,3,4,4aα,5,6-ヘキサヒドロ-1H-2-ピリンジン-3α-カルボン酸メチル
  • (4S,6S)-3-トシル-8-オキソ-9-フェニル-3-アザビシクロ[4.3.0]ノナ-9(1)-エン-4α-カルボン酸メチル
  • メチル (3S,4aS)-2-(4-メチルベンゼンスルホニル)-6-オキソ-7-フェニル-1H,2H,3H,4H,4aH,5H,6H-シクロペンタ[c]ピリジン-3-カルボキシラート
  • methyl (3S,4aS)-2-(4-methylbenzenesulfonyl)-6-oxo-7-phenyl-1H,2H,3H,4H,4aH,5H,6H-cyclopenta[c]pyridine-3-carboxylate
Other name (1)：
  • (4S,6S)-3-Tosyl-8-oxo-9-phenyl-3-azabicyclo[4.3.0]non-9(1)-ene-4α-carboxylic acid methyl ester
Thsaurus map：
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