HRID115272

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID11776

Triphenylphosphine

C18H15P

HCID220568

ethyl N-ethoxycarbonyliminocarbamate

C6H10N2O4

HCID13419136

3-PYRIDINEBUTANOL

C9H13NO

HCID135516666

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(-c2noc(C(F)(F)F)n2)cc(C)c1OCCCCc1cccnc1

HCID19082061

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a6826cc410ae4d86b5e7823a91e33d56
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:61]([Cl:62])[Cl:63].[F:1][C:2]([c:3]1[n:4][c:5](-[c:8]2[cH:9][c:10]([CH3:16])[c:11]([OH:15])[c:12]([CH3:14])[cH:13]2)[n:6][o:7]1)([F:17])[F:18].[O:49]=[C:50]([O:51][CH2:52][CH3:53])[N:54]=[N:55][C:56]([O:57][CH2:58][CH3:59])=[O:60].[OH:19][CH2:20][CH2:21][CH2:22][CH2:23][c:24]1[cH:25][n:26][cH:27][cH:28][cH:29]1.[c:30]1([P:31]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[F:1][C:2]([c:3]1[n:4][c:5](-[c:8]2[cH:9][c:10]([CH3:16])[c:11]([O:15][CH2:20][CH2:21][CH2:22][CH2:23][c:24]3[cH:25][n:26][cH:27][cH:28][cH:29]3)[c:12]([CH3:14])[cH:13]2)[n:6][o:7]1)([F:17])[F:18]