HRID828889

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID2734386

4-(Trifluoromethoxy)phenylboronic acid

C7H6BF3O3

结构：O=C(NC1CN2CCC1CC2)c1cc2cc(F)cc(Br)c2o1

HCID17982829

未命名化合物

PRODUCTS

生成物

结构：O=C(NC1CN2CCC1CC2)c1cc2cc(F)cc(-c3ccc(OC(F)(F)F)cc3)c2o1

HCID17982663

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0b7df47b8ae14609b1f5cf13284927ea
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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