HRID300563

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID2734658

(Bromomethyl)cyclobutane

C5H9Br

结构：CCOC(=O)Cc1cc(Cl)c(OCC(F)(F)F)c(-c2ccc(C(F)(F)F)cc2)c1

HCID57995666

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(CC1CCC1)c1cc(Cl)c(OCC(F)(F)F)c(-c2ccc(C(F)(F)F)cc2)c1

HCID57995519

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3eea88d86f3b4d538221e7e7b156ac67
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH:32]1([CH2:36][Br:37])[CH2:33][CH2:34][CH2:35]1.[Cl-:38].[Cl:1][c:2]1[cH:3][c:4]([CH2:24][C:25](=[O:26])[O:27][CH2:28][CH3:29])[cH:5][c:6](-[c:14]2[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]2)[c:7]1[O:8][CH2:9][C:10]([F:11])([F:12])[F:13].[H-:31].[NH4+:39].[Na+:30].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44]>>[Cl:1][c:2]1[cH:3][c:4]([CH:24]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[CH2:36][CH:32]2[CH2:33][CH2:34][CH2:35]2)[cH:5][c:6](-[c:14]2[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]2)[c:7]1[O:8][CH2:9][C:10]([F:11])([F:12])[F:13]