Chem
J-GLOBAL ID：200907012212371686   Nikkaji number：J1.891.225B

(3aR,7aα)-1-(4-Methoxyphenyl)-2,3,6-trioxooctahydro-1H-indole-3aα-carboxylic acid methyl ester

(3aR,7aα)-1-(4-メトキシフェニル)-2,3,6-トリオキソオクタヒドロ-1H-インドール-3aα-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： C17H17NO6
Molecular formula furigana： C17-H17-N-O6
Molecular weight： 331.324
InChI： InChI=1S/C17H17NO6/c1-23-12-5-3-10(4-6-12)18-13-9-11(19)7-8-17(13,16(22)24-2)14(20)15(18)21/h3-6,13H,7-9H2,1-2H3/t13-,17-/m1/s1
InChI key： XWULMUZTFONKBH-CXAGYDPISA-N
SMILES： COC(=O)[C@]12CCC(=O)C[C@H]1N(C(=O)C2=O)c1ccc(OC)cc1
Systematic name  (3)：
  • (3aR,7aα)-1-(4-メトキシフェニル)-2,3,6-トリオキソオクタヒドロ-1H-インドール-3aα-カルボン酸メチル
  • メチル (3aR,7aR)-1-(4-メトキシフェニル)-2,3,6-トリオキソ-オクタヒドロ-1H-インドール-3a-カルボキシラート
  • methyl (3aR,7aR)-1-(4-methoxyphenyl)-2,3,6-trioxo-octahydro-1H-indole-3a-carboxylate
Other name (1)：
  • (3aR,7aα)-1-(4-Methoxyphenyl)-2,3,6-trioxooctahydro-1H-indole-3aα-carboxylic acid methyl ester
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