HRID1543632

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID3283

Diethyl Ether

C4H10O

HCID85346

4-Octylaniline

C14H23N

HCID24754730

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCc1ccc(NCC2(NC(=O)OC(C)(C)C)COC(C)(C)OC2)cc1

HCID66726563

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-09b132bc482c41f6979ac9b33bf9ff05
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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