HRID197971

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID2757383

Benzyl 3-(hydroxymethyl)piperazine-1-carboxylate

C13H18N2O3

HCID136105032

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc2c(N3CCN(C(=O)OCc4ccccc4)CC3CO)nc(-c3ccccc3O)nc2c1

HCID136121321

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a40097e6f282436b8e5ec8e28905c4ea
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

[CH2:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[O:27][C:28](=[O:29])[N:30]1[CH2:31][CH:32]([CH2:36][OH:37])[NH:33][CH2:34][CH2:35]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[Cl:1][c:2]1[n:3][c:4](-[c:13]2[c:14]([OH:19])[cH:15][cH:16][cH:17][cH:18]2)[n:5][c:6]2[cH:7][c:8]([CH3:12])[cH:9][cH:10][c:11]12.[Cl:45][CH2:46][Cl:47].[OH2:48]>>[c:2]1([N:33]2[CH:32]([CH2:36][OH:37])[CH2:31][N:30]([C:28]([O:27][CH2:20][c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)=[O:29])[CH2:35][CH2:34]2)[n:3][c:4](-[c:13]2[c:14]([OH:19])[cH:15][cH:16][cH:17][cH:18]2)[n:5][c:6]2[cH:7][c:8]([CH3:12])[cH:9][cH:10][c:11]12