HRID955952

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID313

Hydrochloric Acid

ClH

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID181649

3H-1,2,3-Triazolo[4,5-b]pyridine, 3-hydroxy-

C5H4N4O

HCID11955867

未命名化合物

结构：C=C(C)c1cc(C(=O)O)c(OCc2ccccc2)cc1OCc1ccccc1

HCID49864016

5-(1-Methylethenyl)-2,4-bis(phenylmethoxy)benzoic acid

C24H22O4

PRODUCTS

生成物

结构：C=C(C)c1cc(C(=O)N2Cc3ccc(C4(O)CCN(C)CC4)cc3C2)c(OCc2ccccc2)cc1OCc1ccccc1

HCID46915491

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ed7337bdac9644a79cc60701e8edad74
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

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:11](=[O:12])[OH:13])[cH:14][c:15]([C:26](=[CH2:27])[CH3:28])[c:16]([O:18][CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:17]1.[CH2:29]([Cl:30])[CH2:31][Cl:32].[CH2:45]1[NH:46][CH2:47][c:48]2[cH:49][c:50]([C:54]3([OH:61])[CH2:55][CH2:56][N:57]([CH3:60])[CH2:58][CH2:59]3)[cH:51][cH:52][c:53]21.[CH2:72]1[O:73][CH2:74][CH2:75][CH2:76]1.[CH3:62][CH2:63][N:64]([CH2:65][CH3:66])[CH2:67][CH3:68].[CH3:82][CH2:83][O:84][C:85]([CH3:86])=[O:87].[Cl:69][CH2:70][Cl:71].[ClH:43].[ClH:44].[O:77]=[CH:78][N:79]([CH3:80])[CH3:81].[OH:33][n:34]1[c:35]2[n:36][cH:37][cH:38][cH:39][c:40]2[n:41][n:42]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:11](=[O:12])[N:46]2[CH2:45][c:53]3[c:48]([cH:49][c:50]([C:54]4([OH:61])[CH2:55][CH2:56][N:57]([CH3:60])[CH2:58][CH2:59]4)[cH:51][cH:52]3)[CH2:47]2)[cH:14][c:15]([C:26](=[CH2:27])[CH3:28])[c:16]([O:18][CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:17]1