HRID1131296

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID18451534

2-(Bromomethyl)-1-iodo-4-(trifluoromethyl)benzene

C8H5BrF3I

结构：CC1NC(=O)OC1c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID59135245

未命名化合物

PRODUCTS

生成物

结构：CC1C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)OC(=O)N1Cc1cc(C(F)(F)F)ccc1I

HCID76024859

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4ac06bf414a14d5abd21cf4b8977a97a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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