HRID1554230

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID12503

(3-Bromopropyl)benzene

C9H11Br

HCID19660

Carbonate

CO3-2

HCID70320

2-Bromomethylnaphthalene

C11H9Br

结构：CC(C)(C)OC(=O)N1CCC(c2ccc(O)cc2)C(O)C1

HCID21713087

未命名化合物

结构：CC(C)(C)OC(=O)N1CCC(c2ccc(OCCCc3ccccc3)cc2)C(O)C1

HCID86604476

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(c2ccc(OCCCc3ccccc3)cc2)C(OCc2ccc3ccccc3c2)C1

HCID53656586

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-489914c94ecc4b4b85c4a8f2b1782e0a
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

[Br:22][CH2:23][CH2:24][CH2:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[Br:68][CH2:69][c:70]1[cH:71][c:72]2[cH:73][cH:74][cH:75][cH:76][c:77]2[cH:78][cH:79]1.[C:32](=[O:33])([O-:34])[O-:35].[K+:36].[K+:37].[OH:1][CH:2]1[CH:3]([c:4]2[cH:5][cH:6][c:7]([OH:8])[cH:9][cH:10]2)[CH2:11][CH2:12][N:13]([C:14]([O:15][C:16]([CH3:17])([CH3:18])[CH3:19])=[O:20])[CH2:21]1.[OH:38][CH:39]1[CH2:40][N:41]([C:61](=[O:62])[O:63][C:64]([CH3:65])([CH3:66])[CH3:67])[CH2:42][CH2:43][CH:44]1[c:45]1[cH:46][cH:47][c:48]([O:51][CH2:52][CH2:53][CH2:54][c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[cH:49][cH:50]1>>[O:38]([CH:39]1[CH2:40][N:41]([C:61](=[O:62])[O:63][C:64]([CH3:65])([CH3:66])[CH3:67])[CH2:42][CH2:43][CH:44]1[c:45]1[cH:46][cH:47][c:48]([O:51][CH2:52][CH2:53][CH2:54][c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[cH:49][cH:50]1)[CH2:69][c:70]1[cH:71][c:72]2[cH:73][cH:74][cH:75][cH:76][c:77]2[cH:78][cH:79]1