Chem
J-GLOBAL ID：200907036517976592   Nikkaji number：J1.891.218J

(3aR)-1-(4-Methoxyphenyl)-2,3-dioxo-4β-methyl-2,3,3a,4,7,7aα-hexahydro-1H-indole-3aα-carboxylic acid methyl ester

(3aR)-1-(4-メトキシフェニル)-2,3-ジオキソ-4β-メチル-2,3,3a,4,7,7aα-ヘキサヒドロ-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： C18H19NO5
Molecular formula furigana： C18-H19-N-O5
Molecular weight： 329.352
InChI： InChI=1S/C18H19NO5/c1-11-5-4-6-14-18(11,17(22)24-3)15(20)16(21)19(14)12-7-9-13(23-2)10-8-12/h4-5,7-11,14H,6H2,1-3H3/t11-,14+,18+/m0/s1
InChI key： DKGVHNJVJCOUHG-UCMVZMLTSA-N
SMILES： COC(=O)[C@@]12[C@@H](CC=C[C@@H]1C)N(C(=O)C2=O)c1ccc(OC)cc1
Systematic name  (3)：
  • (3aR)-1-(4-メトキシフェニル)-2,3-ジオキソ-4β-メチル-2,3,3a,4,7,7aα-ヘキサヒドロ-1H-インドール-3aα-カルボン酸メチル
  • メチル (3aR,4S,7aR)-1-(4-メトキシフェニル)-4-メチル-2,3-ジオキソ-2,3,3a,4,7,7a-ヘキサヒドロ-1H-インドール-3a-カルボキシラート
  • methyl (3aR,4S,7aR)-1-(4-methoxyphenyl)-4-methyl-2,3-dioxo-2,3,3a,4,7,7a-hexahydro-1H-indole-3a-carboxylate
Other name (1)：
  • (3aR)-1-(4-Methoxyphenyl)-2,3-dioxo-4β-methyl-2,3,3a,4,7,7aα-hexahydro-1H-indole-3aα-carboxylic acid methyl ester
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