HRID194388

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID1140

Toluene

C7H8

HCID16028

Tetrabutylammonium

C16H36N+

HCID61778

Bisulfate anion

HO4S-

HCID68021

4-Fluorobenzyl bromide

C7H6BrF

HCID184361

2H-Acridin-1-one, 9-amino-3,4-dihydro-

C13H12N2O

PRODUCTS

生成物

结构：O=C1CCCc2nc3ccccc3c(NCc3ccc(F)cc3)c21

HCID13935132

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7a5b4561360b44058001d8dbce52cc4d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:40]([N+:41]([CH2:42][CH2:43][CH2:44][CH3:45])([CH2:46][CH2:47][CH2:48][CH3:49])[CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH3:56].[CH3:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1.[F:19][c:20]1[cH:21][cH:22][c:23]([CH2:24][Br:25])[cH:26][cH:27]1.[K+:2].[NH2:3][c:4]1[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]2[n:11][c:12]2[c:17]1[C:16](=[O:18])[CH2:15][CH2:14][CH2:13]2.[OH-:1].[S:35]([O-:36])([OH:37])(=[O:38])=[O:39]>>[NH:3]([c:4]1[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]2[n:11][c:12]2[c:17]1[C:16](=[O:18])[CH2:15][CH2:14][CH2:13]2)[CH2:24][c:23]1[cH:22][cH:21][c:20]([F:19])[cH:27][cH:26]1