HRID678956

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6228

Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID11782

2,3-Dimethylbenzoic acid

C9H10O2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

反应SMILES：COc1cccc(C=Cc2ccc(C(=O)OC(C)(C)C)c(N)c2)c1

HCID67344127

未命名化合物

PRODUCTS

产物

反应SMILES：COc1cccc(C=Cc2ccc(C(=O)OC(C)(C)C)c(NC(=O)c3cccc(C)c3C)c2)c1

HCID67344209

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-e02cbedfdf5f4d6d96c0ebbde297d3c7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

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