HRID204659

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID31275

1,4-Dioxane

C4H8O2

HCID3346446

未命名化合物

HCID11770640

Methyl [4-(bromomethyl)phenyl]acetate

C10H11BrO2

PRODUCTS

生成物

结构：COC(=O)Cc1ccc(CN2CCN(C(c3ccccc3)c3ccccn3)CC2)cc1

HCID19066140

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-54ca9fa93e5640619a2869b64b204f90
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

[Br:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([CH2:9][C:10](=[O:11])[O:12][CH3:13])[cH:7][cH:8]1.[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[O:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1.[c:14]1([CH:20]([N:21]2[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]2)[c:27]2[n:28][cH:29][cH:30][cH:31][cH:32]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[CH2:2]([c:3]1[cH:4][cH:5][c:6]([CH2:9][C:10](=[O:11])[O:12][CH3:13])[cH:7][cH:8]1)[N:24]1[CH2:23][CH2:22][N:21]([CH:20]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:27]2[n:28][cH:29][cH:30][cH:31][cH:32]2)[CH2:26][CH2:25]1