HRID960590

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID784

Hydrogen peroxide

H2O2

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID1099

Sulfite

O3S-2

HCID8028

Tetrahydrofuran

C4H8O

HCID69175

2,4-Dimethoxybenzaldehyde

C9H10O3

结构：CC(C)(C)OC(=O)NCC(C(=O)N1C(=O)OCC1Cc1ccccc1)c1ccc(Cl)cc1

HCID178453548

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NCC(C(=O)O)c1ccc(Cl)cc1

HCID44607837

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-664d89062be34f259cd05b10afb5ca94
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

[CH2:3]([CH:4]1[CH2:5][O:6][C:7](=[O:8])[N:9]1[C:16]([CH:17]([CH2:18][NH:19][C:20]([O:21][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:26])[c:27]1[cH:28][cH:29][c:30]([Cl:33])[cH:31][cH:32]1)=[O:34])[c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1.[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[CH3:35][O:36][c:37]1[cH:38][c:39]([O:40][CH3:41])[cH:42][cH:43][c:44]1[CH:45]=[O:46].[Na+:51].[Na+:52].[OH2:58].[OH:1][OH:2].[S:47]([O-:48])([O-:49])=[O:50]>>[C:16]([CH:17]([CH2:18][NH:19][C:20]([O:21][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:26])[c:27]1[cH:28][cH:29][c:30]([Cl:33])[cH:31][cH:32]1)([OH:34])=[O:36]