HRID146998

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7525

N-Ethylmorpholine

C6H13NO

HCID6453552

N,N-Dimethylpyridin-1-amine

C7H12N2

结构：O=[N+]([O-])c1ccc(S(=O)(=O)Cl)c(OCc2ccccc2)c1

HCID22503984

2-(Benzyloxy)-4-nitrobenzene-1-sulfonyl chloride

C13H10ClNO5S

HCID85818439

未命名化合物

PRODUCTS

生成物

结构：CCOC(OCC)C(CC(=O)OC(C)(C)C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1OCc1ccccc1

HCID69692685

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5ebd601df696464589439a8654fc02b3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([CH:9]([O:10][CH2:11][CH3:12])[O:13][CH2:14][CH3:15])[NH2:16])=[O:17].[CH2:18]([N:19]1[CH2:20][CH2:21][O:22][CH2:23][CH2:24]1)[CH3:25].[CH2:35]([c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)[O:42][c:43]1[c:44]([S:52](=[O:53])(=[O:54])[Cl:55])[cH:45][cH:46][c:47]([N+:49](=[O:50])[O-:51])[cH:48]1.[CH3:26][N:27]([CH3:28])[N:29]1[CH:30]=[CH:31][CH:32]=[CH:33][CH2:34]1.[Cl:56][CH2:57][Cl:58]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([CH:9]([O:10][CH2:11][CH3:12])[O:13][CH2:14][CH3:15])[NH:16][S:52]([c:44]1[c:43]([O:42][CH2:35][c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[cH:48][c:47]([N+:49](=[O:50])[O-:51])[cH:46][cH:45]1)(=[O:53])=[O:54])=[O:17]