HRID1150447

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID992

Pentachlorophenol

C6HCl5O

HCID8857

Ethyl Acetate

C4H8O2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID22757153

未命名化合物

PRODUCTS

产物

HCID22757140

N-benzhydryloxycarbonylglycine pentachlorophenyl ester

C22H14Cl5NO4

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a12459ef69ea4ab29937bc82370ba3f9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

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