HRID802201

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID114942

Titanium(4+)

Ti+4

HCID119440

1-Hydroxyethyl radical

C2H5O-

4 次

HCID15719078

5-Aminoquinolin-2(1H)-one

C9H8N2O

结构：CCC(CC(O)(C=O)C(F)(F)F)c1ccc(F)c(F)c1OC

HCID87219541

未命名化合物

PRODUCTS

生成物

结构：CCC(CC(O)(C=Nc1cccc2[nH]c(=O)ccc12)C(F)(F)F)c1ccc(F)c(F)c1OC

HCID68772119

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5b39414cf9cd4799b99691d726c1e5a3
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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