HRID195392

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID8021

Diethylamine

C4H11N

结构：CCOC(=O)c1c(CCl)nc2cc(OC)c(OC)cc2c1-c1ccc(OC)c(OC)c1

HCID10813243

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1c(CN(CC)CC)nc2cc(OC)c(OC)cc2c1-c1ccc(OC)c(OC)c1

HCID9956900

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1213aefafc6a4680adaaf902f7ca1c3b
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

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