HRID1201081

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID19660

Carbonate

CO3-2

HCID70700

Dipivaloylmethane

C11H20O2

HCID85214

Methyl 4-hydroxy-3-methoxyphenylacetate

C10H12O4

HCID104967

Cesium(1+)

Cs+

2 次

HCID42965003

未命名化合物

PRODUCTS

生成物

结构：COC(=O)Cc1ccc(Oc2ccc(C(=O)NCCc3ccc(Cl)cc3)cc2)c(OC)c1

HCID68464709

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4fbd1079fdb84126b8c64bd56912c71c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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