HRID686425

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID69993

4-Methyloxybenzyl chloride

C8H9ClO

结构：Cc1c(C)c2c(c(C)c1O)C(c1ccc(N3CCOCC3)cc1)C(C)(C)O2

HCID22238254

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(COc2c(C)c(C)c3c(c2C)C(c2ccc(N4CCOCC4)cc2)C(C)(C)O3)cc1

HCID10184756

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4985e7f68cca4a7f8dc051d9a3138461
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH3:1][C:2]1([CH3:27])[O:3][c:4]2[c:5]([c:19]([CH3:26])[c:20]([OH:25])[c:21]([CH3:24])[c:22]2[CH3:23])[CH:6]1[c:7]1[cH:8][cH:9][c:10]([N:13]2[CH2:14][CH2:15][O:16][CH2:17][CH2:18]2)[cH:11][cH:12]1.[CH3:28][O:29][c:30]1[cH:31][cH:32][c:33]([CH2:34][Cl:35])[cH:36][cH:37]1>>[CH3:1][C:2]1([CH3:27])[O:3][c:4]2[c:5]([c:19]([CH3:26])[c:20]([O:25][CH2:34][c:33]3[cH:32][cH:31][c:30]([O:29][CH3:28])[cH:37][cH:36]3)[c:21]([CH3:24])[c:22]2[CH3:23])[CH:6]1[c:7]1[cH:8][cH:9][c:10]([N:13]2[CH2:14][CH2:15][O:16][CH2:17][CH2:18]2)[cH:11][cH:12]1