HRID818717

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID62365

Isobutyl chloroformate

C5H9ClO2

HCID123063

1-(4-Fluorophenyl)ethan-1-amine

C8H10FN

结构：O=C(O)c1cccc([N+](=O)[O-])c1OCc1ccccc1

HCID22272669

3-Nitro-2-(phenylmethoxy)benzoic acid

C14H11NO5

PRODUCTS

生成物

结构：CC(NC(=O)c1cccc([N+](=O)[O-])c1OCc1ccccc1)c1ccc(F)cc1

HCID18551366

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1316af33a3514ba89325e4c986db6e7b
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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