HRID959764

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

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

HCID74255

Benzenesulfonyl chloride, 2,4-dinitro-

C6H3ClN2O6S

结构：OC(c1ccc(N2CCNCC2)cc1)(C(F)(F)F)C(F)(F)F

HCID86623761

未命名化合物

PRODUCTS

生成物

结构：O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(c3ccc(C(O)(C(F)(F)F)C(F)(F)F)cc3)CC2)c([N+](=O)[O-])c1

HCID86670432

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b1e36cae0e1a442da0d2dcff963477f2
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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