HRID179705

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID6344

Dichloromethane

CH2Cl2

HCID13092510

3-(3-Chloropropyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2H-3-benzazepin-2-one

C15H20ClNO3

HCID13579664

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(NCCNCCCN2CCc3cc(OC)c(OC)cc3CC2=O)cc1OC

HCID13579665

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-90c400a440f346f3853aa9d27c89972f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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