HRID1219848

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

3 次

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID6212

Chloroform

CHCl3

HCID6344

Dichloromethane

CH2Cl2

HCID4989215

Pyridinium

C5H6N+

3 次

反应SMILES：COC(=O)C1=C(C)NC2=C(C(=O)C(C)OC2)C1c1ccc(F)c(Br)c1

HCID18000971

未命名化合物

PRODUCTS

产物

反应SMILES：CC1OCC2=C(C1=O)C(c1ccc(F)c(Br)c1)C1=C(COC1=O)N2

HCID10222213

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-dca39b53fa5d468f8e36d35616a5b0b5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应SMILES

[Br-:32].[Br-:33].[Br-:34].[Br:1][c:2]1[cH:3][c:4]([CH:9]2[C:10]3=[C:11]([NH:12][C:13]([CH3:19])=[C:14]2[C:15](=[O:16])[O:17][CH3:18])[CH2:20][O:21][CH:22]([CH3:25])[C:23]3=[O:24])[cH:5][cH:6][c:7]1[F:8].[CH:54]([Cl:55])([Cl:56])[Cl:57].[Cl:58][CH2:59][Cl:60].[ClH:53].[cH:26]1[cH:27][cH:28][n:29][cH:30][cH:31]1.[nH+:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[nH+:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[nH+:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[Br:1][c:2]1[cH:3][c:4]([CH:9]2[C:10]3=[C:11]([NH:12][C:13]4=[C:14]2[C:15](=[O:16])[O:17][CH2:19]4)[CH2:20][O:21][CH:22]([CH3:25])[C:23]3=[O:24])[cH:5][cH:6][c:7]1[F:8]