HRID2153572

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID28486

Lithium ion

Li+

HCID123351

Perchlorate

ClO4-

HCID4571240

未命名化合物

HCID60880031

未命名化合物

PRODUCTS

生成物

结构：C=CCOc1ccc(OC)cc1CNCC(O)C(Cc1ccccc1)NC(=O)OC(C)(C)C

HCID178458538

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-220b31944ba04642a6323d6321146065
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH2:1]([CH:2]=[CH2:3])[O:4][c:5]1[c:6]([CH2:7][NH2:8])[cH:9][c:10]([O:13][CH3:14])[cH:11][cH:12]1.[CH3:40][C:41]#[N:42].[Cl+3:34]([O-:35])([O-:36])([O-:37])[O-:38].[Li+:39].[O:15]1[CH2:16][CH:17]1[CH:18]([CH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[NH:26][C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33]>>[CH2:1]([CH:2]=[CH2:3])[O:4][c:5]1[c:6]([CH2:7][NH:8][CH2:16][CH:17]([OH:15])[CH:18]([CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[NH:26][C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[cH:9][c:10]([O:13][CH3:14])[cH:11][cH:12]1