HRID196100

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID10387

Benzyl chloroformate

C8H7ClO2

HCID81531

Diisopropylethylamine

C8H19N

HCID107316

Ethyl 4-oxopiperidine-3-carboxylate

C8H13NO3

HCID3784394

Ethyl 1-benzoyl-3-piperidinecarboxylate

C15H19NO3

PRODUCTS

生成物

HCID44607763

1-Benzyl 3-ethyl 4-oxopiperidine-1,3-dicarboxylate

C16H19NO5

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6ae4352e6a174a68b93614a75c49c6bd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:1]([N:2]1[CH2:3][CH2:4][CH2:5][CH:6]([C:7]([O:8][CH2:9][CH3:10])=[O:11])[CH2:12]1)(=[O:13])[c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1.[CH:33]([N:34]([CH:35]([CH3:36])[CH3:37])[CH2:38][CH3:39])([CH3:40])[CH3:41].[Cl:42][C:43](=[O:44])[O:45][CH2:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[ClH:20].[NH:21]1[CH2:22][CH:23]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[C:24](=[O:27])[CH2:25][CH2:26]1>>[N:21]1([C:43](=[O:44])[O:45][CH2:46][c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[CH2:22][CH:23]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[C:24](=[O:27])[CH2:25][CH2:26]1