HRID98090

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

3 次

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID3283

Diethyl Ether

C4H10O

HCID4649

p-Aminosalicylic acid

C7H7NO3

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID86628702

未命名化合物

PRODUCTS

产物

HCID24785682

4-(2-(4'-Chlorobiphenyl-4-ylsulfonyloxy)acetamido)-2-hydroxybenzoic acid

C21H16ClNO7S

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-0ee245c281334e6ab342fd457087a9ef
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[C:14](=[O:15])([O-:16])[O-:17].[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:47][CH2:48][O:49][CH2:50][CH3:51].[Cl:20][c:21]1[cH:22][cH:23][c:24](-[c:27]2[cH:28][cH:29][c:30]([S:33](=[O:34])(=[O:35])[O:36][CH2:37][C:38](=[O:39])[Cl:40])[cH:31][cH:32]2)[cH:25][cH:26]1.[NH2:1][c:2]1[cH:3][c:4]([OH:11])[c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[Na+:13].[Na+:18].[Na+:19].[OH-:12].[OH2:41]>>[NH:1]([c:2]1[cH:3][c:4]([OH:11])[c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1)[C:38]([CH2:37][O:36][S:33]([c:30]1[cH:29][cH:28][c:27](-[c:24]2[cH:23][cH:22][c:21]([Cl:20])[cH:26][cH:25]2)[cH:32][cH:31]1)(=[O:34])=[O:35])=[O:39]