HRID1131625

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID23092144

6-Bromo-N,N-dimethyl-3-pyridinecarboxamide

C8H9BrN2O

HCID25067323

Methyl 4-hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-6-carboxylate

C12H14O4

结构：COC(=O)c1cc(Oc2ccc(C(=O)N(C)C)nc2)c2c(c1)OC(C)(C)C2

HCID59560224

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cc(Oc2ccc(C(=O)N(C)C)cn2)c2c(c1)OC(C)(C)C2

HCID59559864

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-72b5e370b2f248fc9fa9b9c05b1cc46e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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