HRID1574936

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID11776

Triphenylphosphine

C18H15P

HCID2733206

tert-Butyl N-(2-hydroxyethyl)carbamate

C7H15NO3

HCID18625875

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(Cc1ccc(OCCNC(=O)OC(C)(C)C)c(Br)c1)Oc1ccccc1

HCID18626002

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3d450469e8824725b0292183130d5ff3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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