HRID162102

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID13103692

4-Chloro-3-methoxyaniline

C7H8ClNO

结构：COc1ccc(C2CCC(C(=O)O)N2C(=O)OC(C)(C)C)cc1OC

HCID178488587

未命名化合物

PRODUCTS

生成物

结构：COc1cc(NC(=O)C2CCC(c3ccc(OC)c(OC)c3)N2C(=O)OC(C)(C)C)ccc1Cl

HCID178493253

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e9ac1aa2a55b447889a9546369d0c08d
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:23](=[O:24])[OH:25])[CH2:10][CH2:11][CH:12]1[c:13]1[cH:14][c:15]([O:21][CH3:22])[c:16]([O:19][CH3:20])[cH:17][cH:18]1.[CH:36]([N:37]([CH2:38][CH3:39])[CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[Cl:26][c:27]1[c:28]([O:34][CH3:35])[cH:29][c:30]([NH2:31])[cH:32][cH:33]1.[Cl:45][CH2:46][Cl:47]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:23](=[O:24])[NH:31][c:30]2[cH:29][c:28]([O:34][CH3:35])[c:27]([Cl:26])[cH:33][cH:32]2)[CH2:10][CH2:11][CH:12]1[c:13]1[cH:14][c:15]([O:21][CH3:22])[c:16]([O:19][CH3:20])[cH:17][cH:18]1