HRID320336

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID947

Nitrogen

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID18451534

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

C8H5BrF3I

结构：O=C1NCC(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)O1

HCID59135069

未命名化合物

PRODUCTS

生成物

结构：O=C1OC(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CN1Cc1cc(C(F)(F)F)ccc1I

HCID59135239

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-79528cab801c42949dd70527a898569e
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

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