Chem
J-GLOBAL ID:200907049465343779   Nikkaji number:J1.073.389H

1-[2-[(5R)-3-(3,4,5-Trimethoxybenzoyl)-5-(3,4-dichlorophenyl)-5α-oxazolidinyl]ethyl]-4-(3-pyridinyl)-4-hydroxypiperidine

1-[2-[(5R)-3-(3,4,5-トリメトキシベンゾイル)-5-(3,4-ジクロロフェニル)-5α-オキサゾリジニル]エチル]-4-(3-ピリジニル)-4-ヒドロキシピペリジン
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: C31H35Cl2N3O6
Molecular formula furigana: C31-H35-CL2-N3-O6
Molecular weight: 616.540
InChI: InChI=1S/C31H35Cl2N3O6/c1-39-26-15-21(16-27(40-2)28(26)41-3)29(37)36-19-31(42-20-36,22-6-7-24(32)25(33)17-22)10-14-35-12-8-30(38,9-13-35)23-5-4-11-34-18-23/h4-7,11,15-18,38H,8-10,12-14,19-20H2,1-3H3/t31-/m0/s1
InChI key: UCYOKEIGNWKFBW-HKBQPEDESA-N
SMILES: COc1cc(cc(OC)c1OC)C(=O)N1CO[C@@](CCN2CCC(O)(CC2)c2cccnc2)(C1)c1ccc(Cl)c(Cl)c1
Systematic name  (3):
  • 1-[2-[(5R)-3-(3,4,5-トリメトキシベンゾイル)-5-(3,4-ジクロロフェニル)-5α-オキサゾリジニル]エチル]-4-(3-ピリジニル)-4-ヒドロキシピペリジン
  • 1-{2-[(5R)-5-(3,4-ジクロロフェニル)-3-(3,4,5-トリメトキシベンゾイル)-1,3-オキサゾリジン-5-イル]エチル}-4-(ピリジン-3-イル)ピペリジン-4-オール
  • 1-{2-[(5R)-5-(3,4-dichlorophenyl)-3-(3,4,5-trimethoxybenzoyl)-1,3-oxazolidin-5-yl]ethyl}-4-(pyridin-3-yl)piperidin-4-ol
Other name (1):
  • 1-[2-[(5R)-3-(3,4,5-Trimethoxybenzoyl)-5-(3,4-dichlorophenyl)-5α-oxazolidinyl]ethyl]-4-(3-pyridinyl)-4-hydroxypiperidine
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