HRID290724

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID21609

N-Ethyl cyclohexylamine

C8H17N

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

结构：COc1ccc2oc(C(=O)C(C)(C)C)c(CC(=O)O)c2c1

HCID57804476

未命名化合物

PRODUCTS

生成物

结构：CCN(C(=O)Cc1c(C(=O)C(C)(C)C)oc2ccc(OC)cc12)C1CCCCC1

HCID11395458

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-609685e7a8b0439ab894bce341e5c0dc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:32]([CH3:33])[NH:34][CH:35]1[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]1.[CH2:55]([Cl:56])[CH2:57][Cl:58].[CH3:1][C:2]([C:3](=[O:4])[c:5]1[o:6][c:7]2[c:8]([c:9]1[CH2:10][C:11](=[O:12])[OH:13])[cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)([CH3:20])[CH3:21].[CH:41]([N:42]([CH2:43][CH3:44])[CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH:22][n:23]1[c:24]2[c:25]([cH:26][cH:27][cH:28][cH:29]2)[n:30][n:31]1>>[CH3:1][C:2]([C:3](=[O:4])[c:5]1[o:6][c:7]2[c:8]([c:9]1[CH2:10][C:11](=[O:12])[N:34]([CH2:32][CH3:33])[CH:35]1[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]1)[cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)([CH3:20])[CH3:21]