HRID1202458

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

HCID81531

Diisopropylethylamine

C8H19N

HCID16770770

Methyl [4-(aminomethyl)phenoxy]acetate

C10H13NO3

HCID57841320

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCC#Cc1ccc(CNCc2ccc(OCC(=O)OC)cc2)cc1

HCID57841392

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f99feeba660a4228aa1b1b216ea6abd1
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

[C:1](#[C:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH3:10])[c:11]1[cH:12][cH:13][c:14]([CH:15]=[O:16])[cH:17][cH:18]1.[CH3:33][C:34](=[O:35])[O-:36].[CH:37]([N:38]([CH2:39][CH3:40])[CH:41]([CH3:42])[CH3:43])([CH3:44])[CH3:45].[NH2:19][CH2:20][c:21]1[cH:22][cH:23][c:24]([O:25][CH2:26][C:27](=[O:28])[O:29][CH3:30])[cH:31][cH:32]1>>[C:1](#[C:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH3:10])[c:11]1[cH:12][cH:13][c:14]([CH2:15][NH:19][CH2:20][c:21]2[cH:22][cH:23][c:24]([O:25][CH2:26][C:27](=[O:28])[O:29][CH3:30])[cH:31][cH:32]2)[cH:17][cH:18]1