HRID2346318

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2759579

2-Methoxy-N-methylaniline

C8H11NO

结构：COc1ccccc1Nc1cccc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)n1

HCID57895123

未命名化合物

结构：O=C(Nc1cccc(Br)n1)C1(c2ccc3c(c2)OCO3)CC1

HCID59165895

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1N(C)c1cccc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)n1

HCID57895152

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-56b4312fcb544d1c80a909b29e2e3bdd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH3:31][O:32][c:33]1[cH:34][cH:35][cH:36][cH:37][c:38]1[NH:39][CH3:40].[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([C:10]1([C:13](=[O:14])[NH:15][c:16]3[n:17][c:18]([NH:22][c:23]4[c:24]([O:29][CH3:30])[cH:25][cH:26][cH:27][cH:28]4)[cH:19][cH:20][cH:21]3)[CH2:11][CH2:12]1)[cH:9]2.[O:41]1[c:42]2[cH:43][cH:44][c:45]([C:46]3([C:47]([NH:48][c:49]4[cH:50][cH:51][cH:52][c:53]([Br:54])[n:55]4)=[O:56])[CH2:57][CH2:58]3)[cH:59][c:60]2[O:61][CH2:62]1>>[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([C:10]1([C:13](=[O:14])[NH:15][c:16]3[n:17][c:18]([N:22]([c:23]4[c:24]([O:29][CH3:30])[cH:25][cH:26][cH:27][cH:28]4)[CH3:31])[cH:19][cH:20][cH:21]3)[CH2:11][CH2:12]1)[cH:9]2