HRID148306

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8857

Ethyl acetate

C4H8O2

HCID2759828

Methyl 4-(bromomethyl)-3-methoxybenzoate

C10H11BrO3

HCID9991466

未命名化合物

HCID178418778

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(Cc2c[nH]c3ccc(C(=O)NCCC(C)C)cc23)c(OC)c1

HCID10364106

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f9df651f97c542a8848ecd5961a4ed33
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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