Chem
J-GLOBAL ID：200907064215853487   Nikkaji number：J363.376D

(3R)-4-[(3,4-Dichlorophenyl)acetyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylic acid methyl ester

(3R)-4-[(3,4-ジクロロフェニル)アセチル]-3-(ピロリジン-1-イルメチル)ピペラジン-1-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： C19H25Cl2N3O3
Molecular formula furigana： C19-H25-CL2-N3-O3
Molecular weight： 414.330
InChI： InChI=1S/C19H25Cl2N3O3/c1-27-19(26)23-8-9-24(15(13-23)12-22-6-2-3-7-22)18(25)11-14-4-5-16(20)17(21)10-14/h4-5,10,15H,2-3,6-9,11-13H2,1H3/t15-/m1/s1
InChI key： HJUAKZYKCANOOZ-OAHLLOKOSA-N
SMILES： COC(=O)N1CCN([C@H](CN2CCCC2)C1)C(=O)Cc1ccc(Cl)c(Cl)c1
Systematic name  (4)：
  • (3R)-3β-[(ピロリジン-1-イル)メチル]-4-[(3,4-ジクロロフェニル)アセチル]ピペラジン-1-カルボン酸メチル
  • (3R)-4-[(3,4-ジクロロフェニル)アセチル]-3-(ピロリジン-1-イルメチル)ピペラジン-1-カルボン酸メチル
  • メチル (3R)-4-[2-(3,4-ジクロロフェニル)アセチル]-3-[(ピロリジン-1-イル)メチル]ピペラジン-1-カルボキシラート
  • methyl (3R)-4-[2-(3,4-dichlorophenyl)acetyl]-3-[(pyrrolidin-1-yl)methyl]piperazine-1-carboxylate
Other name (1)：
  • (3R)-4-[(3,4-Dichlorophenyl)acetyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylic acid methyl ester
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