HRID2160371

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID10131212

3-Ethoxy-4-ethoxycarbonylphenylacetic acid

C13H16O5

结构：CCOC(=O)c1ccc(CC(=O)NC(=CC(C)C)c2ccccc2N2CCCCC2)cc1OCC

HCID53820019

未命名化合物

PRODUCTS

生成物

HCID13729227

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b1ec3cac96fd468a92d273b12f533d07
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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