Chem
J-GLOBAL ID:200907016393097020   Nikkaji number:J783.102A

[2α-(4-Methoxyphenyl)-4β-(2,6-dichlorophenyl)-5α-(3-pyridinyl)pyrrolidin-3α-yl](3-hydroxyphenyl) ketone

[2α-(4-メトキシフェニル)-4β-(2,6-ジクロロフェニル)-5α-(3-ピリジニル)ピロリジン-3α-イル](3-ヒドロキシフェニル)ケトン
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: C29H24Cl2N2O3
Molecular formula furigana: C29-H24-CL2-N2-O3
Molecular weight: 519.419
InChI: InChI=1S/C29H24Cl2N2O3/c1-36-21-12-10-17(11-13-21)27-26(29(35)18-5-2-7-20(34)15-18)25(24-22(30)8-3-9-23(24)31)28(33-27)19-6-4-14-32-16-19/h2-16,25-28,33-34H,1H3/t25-,26-,27-,28+/m1/s1
InChI key: SAQVGPXZVPGKIV-HPQIJTKRSA-N
SMILES: COc1ccc(cc1)[C@H]1N[C@H]([C@@H]([C@H]1C(=O)c1cccc(O)c1)c1c(Cl)cccc1Cl)c1cccnc1
Systematic name  (3):
  • [2α-(4-メトキシフェニル)-4β-(2,6-ジクロロフェニル)-5α-(3-ピリジニル)ピロリジン-3α-イル](3-ヒドロキシフェニル)ケトン
  • 3-[(2S,3R,4S,5R)-4-(2,6-ジクロロフェニル)-2-(4-メトキシフェニル)-5-(ピリジン-3-イル)ピロリジン-3-カルボニル]フェノール
  • 3-[(2S,3R,4S,5R)-4-(2,6-dichlorophenyl)-2-(4-methoxyphenyl)-5-(pyridin-3-yl)pyrrolidine-3-carbonyl]phenol
Other name (1):
  • [2α-(4-Methoxyphenyl)-4β-(2,6-dichlorophenyl)-5α-(3-pyridinyl)pyrrolidin-3α-yl](3-hydroxyphenyl) ketone
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