HRID1231169

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID81531

Diisopropylethylamine

C8H19N

HCID164578

4-Trifluoromethylsalicylic acid

C8H5F3O3

HCID187201

N-Boc-ethylenediamine

C7H16N2O2

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NCCNC(=O)c1ccc(C(F)(F)F)cc1O

HCID67493387

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c4ef2a749a4e446a81801592a656345a
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

[CH:32]([N:33]([CH:34]([CH3:35])[CH3:36])[CH2:37][CH3:38])([CH3:39])[CH3:40].[Cl:15][C:16]([C:17]([Cl:18])=[O:19])=[O:20].[Cl:41][CH2:42][Cl:43].[NH2:21][CH2:22][CH2:23][NH:24][C:25]([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48].[OH:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][cH:8][c:9]([C:11]([F:12])([F:13])[F:14])[cH:10]1>>[OH:1][c:2]1[c:3]([C:4](=[O:6])[NH:21][CH2:22][CH2:23][NH:24][C:25]([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:31])[cH:7][cH:8][c:9]([C:11]([F:12])([F:13])[F:14])[cH:10]1