HRID2122233

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID12053

2-Phenylpropan-2-ol

C9H12O

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID18953969

未命名化合物

PRODUCTS

生成物

结构：CC(C)(OC(=O)CCc1nc(-c2ccc(Cl)cc2)co1)c1ccccc1

HCID18953956

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c3365eaf60d748bc8a775bede5742bc6
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

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