HRID1558916

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8021

Diethylamine

C4H11N

结构：CC(C)(C)OC(=O)C(CCC(=O)NCCOCCOCCOCCN=[N+]=[N-])NC(=O)OCC1c2ccccc2-c2ccccc21

HCID178451011

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)C(N)CCC(=O)NCCOCCOCCOCCN=[N+]=[N-]

HCID178451257

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9418d238f27e4e22893e8a284720fdcf
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

[CH2:46]([NH:47][CH2:48][CH3:49])[CH3:50].[CH2:51]([Cl:52])[Cl:53].[N:1](=[N+:2]=[N-:3])[CH2:4][CH2:5][O:6][CH2:7][CH2:8][O:9][CH2:10][CH2:11][O:12][CH2:13][CH2:14][NH:15][C:16](=[O:17])[CH2:18][CH2:19][CH:20]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[NH:28][C:29]([O:30][CH2:31][CH:32]1[c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2-[c:39]2[c:40]1[cH:41][cH:42][cH:43][cH:44]2)=[O:45]>>[N:1](=[N+:2]=[N-:3])[CH2:4][CH2:5][O:6][CH2:7][CH2:8][O:9][CH2:10][CH2:11][O:12][CH2:13][CH2:14][NH:15][C:16](=[O:17])[CH2:18][CH2:19][CH:20]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[NH2:28]