HRID182157

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6212

Chloroform

CHCl3

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID12069538

未命名化合物

结构：COc1ccc(C(=O)O)c(OCCCNC(=O)OC(C)(C)C)c1

HCID68532307

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(=O)Nc2cnccc2NC(=O)c2ccc(OC)cc2OCCCNC(=O)OC(C)(C)C)cc1

HCID69492866

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9a3f67b8897b46fbb5dd3030fa65bd36
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][CH2:11][O:12][c:13]1[c:14]([C:15](=[O:16])[OH:17])[cH:18][cH:19][c:20]([O:22][CH3:23])[cH:21]1.[CH3:30][O:31][c:32]1[cH:33][cH:34][c:35]([C:36](=[O:37])[NH:38][c:39]2[cH:40][n:41][cH:42][cH:43][c:44]2[NH2:45])[cH:46][cH:47]1.[CH:57]([Cl:58])([Cl:59])[Cl:60].[Cl:24][C:25]([C:26]([Cl:27])=[O:28])=[O:29].[Cl:54][CH2:55][Cl:56].[O:61]=[CH:62][N:63]([CH3:64])[CH3:65].[cH:48]1[cH:49][cH:50][n:51][cH:52][cH:53]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][CH2:11][O:12][c:13]1[c:14]([C:15](=[O:17])[NH:45][c:44]2[c:39]([NH:38][C:36]([c:35]3[cH:34][cH:33][c:32]([O:31][CH3:30])[cH:47][cH:46]3)=[O:37])[cH:40][n:41][cH:42][cH:43]2)[cH:18][cH:19][c:20]([O:22][CH3:23])[cH:21]1