HRID1572272

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID176

Acetic Acid

C2H4O2

HCID923

Sodium ion

Na+

2 次

HCID961

Hydroxide

HO-

HCID83641

3-Quinolinecarboxaldehyde

C10H7NO

HCID2724942

未命名化合物

HCID15380699

1,1-Dimethylethyl 4-[(2-methylpropyl)amino]-1-piperidinecarboxylate

C14H28N2O2

PRODUCTS

生成物

结构：CC(C)CN(Cc1cnc2ccccc2c1)C1CCN(C(=O)OC(C)(C)C)CC1

HCID68574520

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-12eda9b5fbf84fd687009ebe7c17f94c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH2:23][CH2:24][CH:25]([NH:28][CH2:29][CH:30]([CH3:31])[CH3:32])[CH2:26][CH2:27]1.[C:1]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[CH3:45][C:46](=[O:47])[OH:48].[Cl:51][CH2:52][CH2:53][Cl:54].[Na+:14].[Na+:50].[OH-:49].[n:33]1[cH:34][c:35]([CH:43]=[O:44])[cH:36][c:37]2[cH:38][cH:39][cH:40][cH:41][c:42]12>>[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH2:23][CH2:24][CH:25]([N:28]([CH2:29][CH:30]([CH3:31])[CH3:32])[CH2:43][c:35]2[cH:34][n:33][c:42]3[c:37]([cH:36]2)[cH:38][cH:39][cH:40][cH:41]3)[CH2:26][CH2:27]1