HRID2346751

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID1140

Toluene

C7H8

HCID7375

3-(Trifluoromethyl)aniline

C7H6F3N

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

结构：CCOC(=O)c1noc2cc(O[Si](C(C)C)(C(C)C)C(C)C)ccc12

HCID66992615

未命名化合物

PRODUCTS

生成物

结构：CC(C)[Si](Oc1ccc2c(C(=O)Nc3cccc(C(F)(F)F)c3)noc2c1)(C(C)C)C(C)C

HCID66992982

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-065b45f9965c4481956ea188451756f0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:12]([O:14][C:15](=[O:13])[c:17]1[n:18][o:19][c:20]2[c:21]1[cH:22][cH:23][c:24]([O:26][Si:27]([CH:28]([CH3:29])[CH3:30])([CH:31]([CH3:32])[CH3:33])[CH:34]([CH3:35])[CH3:36])[cH:25]2)[CH3:16].[CH2:52]1[O:53][CH2:54][CH2:55][CH2:56]1.[CH3:39][CH2:40][O:41][C:42]([CH3:43])=[O:44].[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[Cl-:37].[F:1][C:2]([c:3]1[cH:4][c:5]([NH2:6])[cH:7][cH:8][cH:9]1)([F:10])[F:11].[NH4+:38]>>[F:1][C:2]([c:3]1[cH:4][c:5]([NH:6][C:15](=[O:14])[c:17]2[n:18][o:19][c:20]3[c:21]2[cH:22][cH:23][c:24]([O:26][Si:27]([CH:28]([CH3:29])[CH3:30])([CH:31]([CH3:32])[CH3:33])[CH:34]([CH3:35])[CH3:36])[cH:25]3)[cH:7][cH:8][cH:9]1)([F:10])[F:11]