Chem
J-GLOBAL ID:200907025510669919   Nikkaji number:J1.337.962I

2,6-Dimethyl-4-(3-nitro-4-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid 3-(4-piperidinyl)5-benzyl ester

2,6-ジメチル-4-(3-ニトロ-4-クロロフェニル)-1,4-ジヒドロピリジン-3,5-ジカルボン酸3-(4-ピペリジニル)5-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: C27H28ClN2[N+]O5[O-]
Molecular formula furigana: C27-H28-CL-N3-O6
Molecular weight: 525.990
InChI: InChI=1S/C27H28ClN3O6/c1-16-23(26(32)36-15-18-6-4-3-5-7-18)25(19-8-9-21(28)22(14-19)31(34)35)24(17(2)30-16)27(33)37-20-10-12-29-13-11-20/h3-9,14,20,25,29-30H,10-13,15H2,1-2H3
InChI key: APZPMFFVJMCOLI-UHFFFAOYSA-N
SMILES: CC1=C(C(C(=C(C)N1)C(=O)OC1CCNCC1)c1ccc(Cl)c(c1)[N+](=O)[O-])C(=O)OCc1ccccc1
Systematic name  (3):
  • 2,6-ジメチル-4-(3-ニトロ-4-クロロフェニル)-1,4-ジヒドロピリジン-3,5-ジカルボン酸3-(4-ピペリジニル)5-ベンジル
  • 3-ベンジル 5-ピペリジン-4-イル 4-(4-クロロ-3-ニトロフェニル)-2,6-ジメチル-1,4-ジヒドロピリジン-3,5-ジカルボキシラート
  • 3-benzyl 5-piperidin-4-yl 4-(4-chloro-3-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Other name (1):
  • 2,6-Dimethyl-4-(3-nitro-4-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid 3-(4-piperidinyl)5-benzyl ester
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