HRID190182

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6365

1,1-Dichloroethane

C2H4Cl2

HCID29877

3-Aminophenyl dimethylcarbamate

C9H12N2O2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID23282848

1-(tert-Butoxycarbonyl)-4-methylpiperidine-4-carboxylic acid

C12H21NO4

PRODUCTS

生成物

结构：CN(C)C(=O)Oc1cccc(NC(=O)C2(C)CCN(C(=O)OC(C)(C)C)CC2)c1

HCID67037209

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a66649bcfec6450aa7c30bb1a5e3778c
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]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[OH:16])([CH3:17])[CH2:12][CH2:13]1.[CH2:18]([Cl:19])[CH2:20][Cl:21].[CH3:36][N:37]([C:38]([O:39][c:40]1[cH:41][c:42]([NH2:46])[cH:43][cH:44][cH:45]1)=[O:47])[CH3:48].[Cl:32][CH:33]([Cl:34])[CH3:35].[OH:22][n:23]1[c:24]2[c:25]([cH:26][cH:27][cH:28][cH:29]2)[n:30][n:31]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:16])[NH:46][c:42]2[cH:41][c:40]([O:39][C:38]([N:37]([CH3:36])[CH3:48])=[O:47])[cH:45][cH:44][cH:43]2)([CH3:17])[CH2:12][CH2:13]1