HRID2328418

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID70042

3-Benzyloxybenzyl alcohol

C14H13ClO

HCID10729163

Ethyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate

C14H17NO3

结构：COc1ccc2c(c1)c(CC(=O)O)c(C)n2Cc1ccc(OCc2ccccc2)cc1

HCID21191889

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)Cc1c(C)n(Cc2ccc(OCc3ccccc3)cc2)c2ccc(OC)cc12

HCID53700123

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5859701791e147578b225b3e44baf74a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH2:15][n:16]2[c:17]([CH3:31])[c:18]([CH2:27][C:28](=[O:29])[OH:30])[c:19]3[cH:20][c:21]([O:25][CH3:26])[cH:22][cH:23][c:24]23)[cH:13][cH:14]1.[CH2:32]([CH3:33])[O:34][C:35](=[O:36])[CH2:37][c:38]1[c:39]2[c:40]([cH:41][cH:42][c:43]([O:44][CH3:45])[cH:46]2)[nH:47][c:48]1[CH3:49].[CH2:50]([O:51][c:52]1[cH:53][cH:54][c:55]([CH2:56][Cl:57])[cH:58][cH:59]1)[c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH2:15][n:16]2[c:17]([CH3:31])[c:18]([CH2:27][C:28]([O:29][CH2:32][CH3:33])=[O:30])[c:19]3[cH:20][c:21]([O:25][CH3:26])[cH:22][cH:23][c:24]23)[cH:13][cH:14]1