HRID2334041

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID12328

Methyl hydrogen adipate

C7H12O4

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID64982631

未命名化合物

PRODUCTS

生成物

结构：COC(=O)CCCCC(=O)NCC(=O)c1cc(Cl)ccc1OC

HCID68492499

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3aed885bd1ce4b5c83bda9f53bb9503f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH3:13][O:14][C:15]([CH2:16][CH2:17][CH2:18][CH2:19][C:20](=[O:21])[OH:22])=[O:23].[CH3:2][N:3]([CH3:4])[CH2:5][CH2:6][CH2:7][N:8]=[C:9]=[N:10][CH2:11][CH3:12].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[Cl:45][CH2:46][Cl:47].[ClH:1].[ClH:24].[NH2:25][CH2:26][C:27](=[O:28])[c:29]1[c:30]([O:36][CH3:37])[cH:31][cH:32][c:33]([Cl:35])[cH:34]1>>[CH3:13][O:14][C:15]([CH2:16][CH2:17][CH2:18][CH2:19][C:20](=[O:22])[NH:25][CH2:26][C:27](=[O:28])[c:29]1[c:30]([O:36][CH3:37])[cH:31][cH:32][c:33]([Cl:35])[cH:34]1)=[O:23]