HRID1208995

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID3283

Diethyl Ether

C4H10O

2 次

HCID9550

Diazomethane

CH2N2

HCID12699

N-Nitroso-N-methylurea

C2H5N3O2

结构：C=C(C(=O)OC(c1ccccc1)c1ccccc1)c1c(F)cc(C(=O)OCC)c(F)c1F

HCID10094769

未命名化合物

PRODUCTS

生成物

结构：CC=C(C(=O)OC(c1ccccc1)c1ccccc1)c1c(F)cc(C(=O)OCC)c(F)c1F

HCID53699771

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b991c5586e52478aabfb267f59f07c47
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

[CH2:33]([O:34][CH2:35][CH3:36])[CH3:37].[CH3:41][N:42]([N:43]=[O:44])[C:45]([NH2:46])=[O:47].[CH3:48][CH2:49][O:50][CH2:51][CH3:52].[CH3:53][c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1.[N+:38](=[CH2:39])=[N-:40].[c:1]1([CH:7]([O:8][C:9](=[O:10])[C:11](=[CH2:12])[c:13]2[c:14]([F:26])[c:15]([F:25])[c:16]([C:17](=[O:18])[O:19][CH2:20][CH3:21])[cH:22][c:23]2[F:24])[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([O:8][C:9](=[O:10])[C:11](=[CH:12][CH3:33])[c:13]2[c:14]([F:26])[c:15]([F:25])[c:16]([C:17](=[O:18])[O:19][CH2:20][CH3:21])[cH:22][c:23]2[F:24])[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1