Chem
J-GLOBAL ID:200907089847769913   Nikkaji number:J761.307E

RS-57639

2-メトキシ-4-アミノ-5-クロロ安息香酸[1-[3-[(2,3-ジヒドロ-1,4-ベンゾジオキシン)-6-イル]プロピル]ピペリジン-4-イル]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: C25H31ClN2O5
Molecular formula furigana: C25-H31-CL-N2-O5
Molecular weight: 474.980
InChI: InChI=1S/C25H31ClN2O5/c1-30-23-15-21(27)20(26)14-19(23)25(29)33-16-18-6-9-28(10-7-18)8-2-3-17-4-5-22-24(13-17)32-12-11-31-22/h4-5,13-15,18H,2-3,6-12,16,27H2,1H3
InChI key: AJVNZBQUOHOEQO-UHFFFAOYSA-N
SMILES: COc1cc(N)c(Cl)cc1C(=O)OCC1CCN(CCCc2ccc3OCCOc3c2)CC1
Systematic name  (3):
  • 2-メトキシ-4-アミノ-5-クロロ安息香酸[1-[3-[(2,3-ジヒドロ-1,4-ベンゾジオキシン)-6-イル]プロピル]ピペリジン-4-イル]メチル
  • {1-[3-(2,3-ジヒドロ-1,4-ベンゾジオキシン-6-イル)プロピル]ピペリジン-4-イル}メチル 4-アミノ-5-クロロ-2-メトキシベンゾアート
  • {1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propyl]piperidin-4-yl}methyl 4-amino-5-chloro-2-methoxybenzoate
Other name (2):
  • RS-57639
  • 2-Methoxy-4-amino-5-chlorobenzoic acid [1-[3-[(2,3-dihydro-1,4-benzodioxin)-6-yl]propyl]piperidin-4-yl]methyl ester
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