HRID825544

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID7912

Diisopropylamine

C6H15N

HCID66053

N,N-Dimethylethylenediamine

C4H12N2

结构：COc1cc(C(=O)O)ccc1OCCCCCOc1ccc(C#N)cc1

HCID18991735

未命名化合物

PRODUCTS

生成物

结构：COc1cc(C(=O)N(C(C)C)C(C)C)ccc1OCCCCCOc1ccc(C#N)cc1

HCID18991695

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-70b13732700742c3ae2bfea7b21fda8a
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:14](#[N:15])[c:16]1[cH:17][cH:18][c:19]([O:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][O:26][c:27]2[c:28]([O:36][CH3:37])[cH:29][c:30]([C:31](=[O:32])[OH:33])[cH:34][cH:35]2)[cH:38][cH:39]1.[CH3:8][N:9]([CH3:10])[CH2:11][CH2:12][NH2:13].[CH:1]([CH3:2])([CH3:3])[NH:4][CH:5]([CH3:6])[CH3:7].[Cl:41][CH2:42][Cl:43].[OH2:40]>>[CH:1]([CH3:2])([CH3:3])[N:4]([CH:5]([CH3:6])[CH3:7])[C:31]([c:30]1[cH:29][c:28]([O:36][CH3:37])[c:27]([O:26][CH2:25][CH2:24][CH2:23][CH2:22][CH2:21][O:20][c:19]2[cH:18][cH:17][c:16]([C:14]#[N:15])[cH:39][cH:38]2)[cH:35][cH:34]1)=[O:32]