HRID1228550

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7618

Triethanolamine

C6H15NO3

HCID79846

Methyl chloroglyoxylate

C3H3ClO3

结构：COc1c(C(C)=O)ccc(OCCCOc2cccc(N)c2)c1CCC(F)(F)F

HCID19818585

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(=O)Nc1cccc(OCCCOc2ccc(C(C)=O)c(OC)c2CCC(F)(F)F)c1

HCID19818626

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8abc3428d67e47a59649a2ebce8eac93
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:1]([C:2](=[O:3])[O:4][CH3:5])(=[O:6])[Cl:7].[C:8]([CH3:9])(=[O:10])[c:11]1[c:12]([O:35][CH3:36])[c:13]([CH2:29][CH2:30][C:31]([F:32])([F:33])[F:34])[c:14]([O:15][CH2:16][CH2:17][CH2:18][O:19][c:20]2[cH:21][c:22]([NH2:23])[cH:24][cH:25][cH:26]2)[cH:27][cH:28]1.[CH2:47]([Cl:48])[Cl:49].[OH:37][CH2:38][CH2:39][N:40]([CH2:41][CH2:42][OH:43])[CH2:44][CH2:45][OH:46]>>[C:1]([C:2](=[O:3])[O:4][CH3:5])(=[O:6])[NH:23][c:22]1[cH:21][c:20]([O:19][CH2:18][CH2:17][CH2:16][O:15][c:14]2[c:13]([CH2:29][CH2:30][C:31]([F:32])([F:33])[F:34])[c:12]([O:35][CH3:36])[c:11]([C:8]([CH3:9])=[O:10])[cH:28][cH:27]2)[cH:26][cH:25][cH:24]1