HRID314435

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID11875

2-Nitrobenzoyl chloride

C7H4ClNO3

HCID53404429

未命名化合物

PRODUCTS

生成物

结构：COc1cc(Nc2ncc(C(C)NC(=O)c3ccccc3[N+](=O)[O-])nn2)cc(OC)c1OC

HCID58711978

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-33fe870bb61843f2abaa055be37b5314
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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