HRID1148616

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6342

Acetonitrile

C2H3N

结构：CN1CCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)CC1

HCID77157

Enpiperate

C20H23NO3

HCID13362919

2-Bromo-N-(1,2-oxazol-3-yl)acetamide

C5H5BrN2O2

PRODUCTS

生成物

HCID259

Bromide

Br-

结构：C[N+]1(CC(=O)Nc2ccon2)CCC(OC(=O)C(O)(c2ccccc2)c2ccccc2)CC1

HCID86634224

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ab28a9b7b1584c9d8307b64d0dc9a69d
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:25][CH2:26][C:27](=[O:28])[NH:29][c:30]1[n:31][o:32][cH:33][cH:34]1.[CH3:1][N:2]1[CH2:3][CH2:4][CH:5]([O:8][C:9]([C:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[OH:23])=[O:24])[CH2:6][CH2:7]1.[CH3:36][C:37]#[N:38].[OH2:35]>>[Br-:25].[CH3:1][N+:2]1([CH2:26][C:27](=[O:28])[NH:29][c:30]2[n:31][o:32][cH:33][cH:34]2)[CH2:3][CH2:4][CH:5]([O:8][C:9]([C:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[OH:23])=[O:24])[CH2:6][CH2:7]1