HRID2125522

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID11011

Trichloroacetonitrile

C2Cl3N

HCID11776

Triphenylphosphine

C18H15P

HCID57796896

未命名化合物

HCID57796897

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(COc2ccc(C(=O)N(C)c3ccc(Oc4ccccc4)cc3C(=O)NC(C)C)cc2Cl)cc1OC

HCID57796888

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-54789de7b92e403eb0822edad13caf42
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

[CH2:72]1[O:73][CH2:74][CH2:75][CH2:76]1.[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][O:7][c:8]2[c:9]([Cl:17])[cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][cH:16]2)[cH:18][cH:19][c:20]1[O:21][CH3:22].[CH:48]([CH3:49])([CH3:50])[NH:51][C:52]([c:53]1[c:54]([NH:66][CH3:67])[cH:55][cH:56][c:57]([O:59][c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)[cH:58]1)=[O:68].[Cl:23][C:24]([Cl:25])([Cl:26])[C:27]#[N:28].[Cl:69][CH2:70][Cl:71].[c:29]1([P:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:43][cH:44][cH:45][cH:46][cH:47]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][O:7][c:8]2[c:9]([Cl:17])[cH:10][c:11]([C:12](=[O:14])[N:66]([c:54]3[c:53]([C:52]([NH:51][CH:48]([CH3:49])[CH3:50])=[O:68])[cH:58][c:57]([O:59][c:60]4[cH:61][cH:62][cH:63][cH:64][cH:65]4)[cH:56][cH:55]3)[CH3:67])[cH:15][cH:16]2)[cH:18][cH:19][c:20]1[O:21][CH3:22]