HRID1575182

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID7964

Chlorobenzene

C6H5Cl

HCID7966

Cyclohexanol

C6H12O

HCID112414

Ethanamine, 2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]-

C15H33NO6

HCID166653

Hydride

H-

反应SMILES：CS(=O)(=O)Nc1cc([N+](=O)[O-])ccc1F

HCID4416401

N-(2-fluoro-5-nitrophenyl)methanesulfonamide

C7H7FN2O4S

PRODUCTS

产物

反应SMILES：CS(=O)(=O)Nc1cc([N+](=O)[O-])ccc1OC1CCCCC1

HCID22406120

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-2e4d36cab08c4d9ab185204b07f81cb1
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

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