Chem
J-GLOBAL ID：200907086303241878   Nikkaji number：J2.500.007B

4,4′-Trimethylenebis(1-piperidinecarboxylic acid α-methyl-2-nitrobenzyl) ester

4,4′-トリメチレンビス(1-ピペリジンカルボン酸α-メチル-2-ニトロベンジル)
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： C31H40N2[N+]2O6[O-]2
Molecular formula furigana： C31-H40-N4-O8
Molecular weight： 596.681
InChI： InChI=1S/C31H40N4O8/c1-22(26-10-3-5-12-28(26)34(38)39)42-30(36)32-18-14-24(15-19-32)8-7-9-25-16-20-33(21-17-25)31(37)43-23(2)27-11-4-6-13-29(27)35(40)41/h3-6,10-13,22-25H,7-9,14-21H2,1-2H3
InChI key： GXXSBQZQAHCKGI-UHFFFAOYSA-N
SMILES： CC(OC(=O)N1CCC(CCCC2CCN(CC2)C(=O)OC(C)c2ccccc2[N+](=O)[O-])CC1)c1ccccc1[N+](=O)[O-]
Systematic name  (5)：
  • 1,3-プロパンジイルビス(4,1-ピペリジンジイル)ビス(ぎ酸α-メチル-2-ニトロベンジル)
  • 4,4′-トリメチレンビス(1-ピペリジンカルボン酸α-メチル-2-ニトロベンジル)
  • 4,4′-トリメチレンビス(ピペリジン-1-カルボン酸α-メチル-2-ニトロベンジル)
  • 1-(2-ニトロフェニル)エチル 4-[3-(1-{[1-(2-ニトロフェニル)エトキシ]カルボニル}ピペリジン-4-イル)プロピル]ピペリジン-1-カルボキシラート
  • 1-(2-nitrophenyl)ethyl 4-[3-(1-{[1-(2-nitrophenyl)ethoxy]carbonyl}piperidin-4-yl)propyl]piperidine-1-carboxylate
Other name (3)：
  • 1,3-Propanediylbis(4,1-piperidinediyl)bis(formic acid α-methyl-2-nitrobenzyl) ester
  • 4,4′-Trimethylenebis(1-piperidinecarboxylic acid α-methyl-2-nitrobenzyl) ester
  • 4,4′-Trimethylenebis(piperidine-1-carboxylic acid α-methyl-2-nitrobenzyl) ester
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