HRID183324

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7498

alpha-Bromotoluene

C7H7Br

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

结构：CC(C)CC(C(=O)O)C(CC=Cc1ccccc1)C(=O)OC(C)(C)C

HCID69711055

未命名化合物

PRODUCTS

生成物

结构：CC(C)CC(C(=O)OCc1ccccc1)C(CC=Cc1ccccc1)C(=O)OC(C)(C)C

HCID178445440

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-735bfbd380824b53b5dc685932e59b88
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

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