HRID1561904

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID784

Hydrogen peroxide

H2O2

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID28486

Lithium ion

Li+

结构：CC(C)(C)OC(=O)N1Cc2ccccc2CC1C(O)C(Cc1cc(F)cc(F)c1)C(=O)N1C(=O)OCC1Cc1ccccc1

HCID178451479

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1Cc2ccccc2CC1C(O)C(Cc1cc(F)cc(F)c1)C(=O)O

HCID178451480

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bded36e202dd4327ba14118b7614b042
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

[CH2:55]1[O:56][CH2:57][CH2:58][CH2:59]1.[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[F:1][c:2]1[cH:3][c:4]([CH2:5][CH:6]([CH:7]([OH:8])[CH:9]2[N:10]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:11][c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]3[CH2:18]2)[C:26](=[O:27])[N:28]2[CH:29]([CH2:30][c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[CH2:37][O:38][C:39]2=[O:40])[cH:41][c:42]([F:44])[cH:43]1.[Li+:46].[OH-:45].[OH2:60].[OH:47][OH:48]>>[F:1][c:2]1[cH:3][c:4]([CH2:5][CH:6]([CH:7]([OH:8])[CH:9]2[N:10]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:11][c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]3[CH2:18]2)[C:26](=[O:27])[OH:51])[cH:41][c:42]([F:44])[cH:43]1