HRID1145957

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6342

Acetonitrile

C2H3N

HCID30165

Iodide ion

I-

HCID81531

Diisopropylethylamine

C8H19N

结构：CC(C)(C)[Si](C)(C)OC(CBr)c1ccc(OCc2ccccc2)c(CO)c1

HCID22935161

未命名化合物

HCID57516949

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cccc(CC(C)(C)NCC(O[Si](C)(C)C(C)(C)C)c2ccc(OCc3ccccc3)c(CO)c2)c1

HCID178497751

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ae22a9f6b993480bbe12800450858477
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

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