HRID2126793

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

4 次

HCID6344

Dichloromethane

CH2Cl2

HCID115139

Zirconium cation (4+)

Zr+4

结构：O=S(=O)(c1ccccc1)N(F)S(=O)(=O)c1ccccc1

HCID588007

N-Fluorobenzenesulfonimide

C12H10FNO4S2

结构：CC1(c2ccc3cc(OC4CCC(C(C)(C)C)CC4)ccc3c2)COC(=O)N1

HCID67414117

未命名化合物

PRODUCTS

生成物

结构：CC1(c2ccc3c(F)c(OC4CCC(C(C)(C)C)CC4)ccc3c2)COC(=O)N1

HCID67413234

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d18064e5edb4416aa55fc0f25ca50269
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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