Chem
J-GLOBAL ID:200907007547324948   Nikkaji number:J1.459.283K

1-(3,4-Dimethoxybenzyl)-6-oxo-7-methoxy-7-acetoxy-1,2,3,4,6,7-hexahydroisoquinoline-2-carboxylic acid ethyl ester

1-(3,4-ジメトキシベンジル)-6-オキソ-7-メトキシ-7-アセトキシ-1,2,3,4,6,7-ヘキサヒドロイソキノリン-2-カルボン酸エチル
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: C24H29NO8
Molecular formula furigana: C24-H29-N-O8
Molecular weight: 459.495
InChI: InChI=1S/C24H29NO8/c1-6-32-23(28)25-10-9-17-13-22(27)24(31-5,33-15(2)26)14-18(17)19(25)11-16-7-8-20(29-3)21(12-16)30-4/h7-8,12-14,19H,6,9-11H2,1-5H3
InChI key: NWPFHPJMIAIIDV-UHFFFAOYSA-N
SMILES: CCOC(=O)N1CCC2=CC(=O)C(OC)(OC(=O)C)C=C2C1Cc1ccc(OC)c(OC)c1
Systematic name  (3):
  • 1-(3,4-ジメトキシベンジル)-6-オキソ-7-メトキシ-7-アセトキシ-1,2,3,4,6,7-ヘキサヒドロイソキノリン-2-カルボン酸エチル
  • エチル 7-(アセチルオキシ)-1-[(3,4-ジメトキシフェニル)メチル]-7-メトキシ-6-オキソ-1,2,3,4,6,7-ヘキサヒドロイソキノリン-2-カルボキシラート
  • ethyl 7-(acetyloxy)-1-[(3,4-dimethoxyphenyl)methyl]-7-methoxy-6-oxo-1,2,3,4,6,7-hexahydroisoquinoline-2-carboxylate
Other name (1):
  • 1-(3,4-Dimethoxybenzyl)-6-oxo-7-methoxy-7-acetoxy-1,2,3,4,6,7-hexahydroisoquinoline-2-carboxylic acid ethyl ester
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