HRID809310

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

3 次

HCID962

Water

H2O

HCID1061

Phosphate

O4P-3

HCID8857

Ethyl acetate

C4H8O2

HCID31275

1,4-Dioxane

C4H8O2

HCID3803620

N,N-Dimethyl-1-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine

C15H24BNO2

结构：CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(Br)cc21

HCID67465227

未命名化合物

PRODUCTS

生成物

结构：CCC(C)n1cc(C)c2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(-c3cccc(CN(C)C)c3)cc21

HCID67467878

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d0dc00d8d78f4781bd719fa2a35871d7
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

[Br:1][c:2]1[cH:3][c:4]([C:16](=[O:17])[NH:18][CH2:19][c:20]2[c:21](=[O:28])[nH:22][c:23]([CH3:27])[cH:24][c:25]2[CH3:26])[c:5]2[c:6]([CH3:15])[cH:7][n:8]([CH:11]([CH3:12])[CH2:13][CH3:14])[c:9]2[cH:10]1.[CH2:57]1[O:58][CH2:59][CH2:60][O:61][CH2:62]1.[CH3:30][N:31]([CH2:32][c:33]1[cH:34][c:35]([B:39]2[O:40][C:41]([CH3:42])([CH3:43])[C:44]([CH3:45])([CH3:46])[O:47]2)[cH:36][cH:37][cH:38]1)[CH3:48].[CH3:63][CH2:64][O:65][C:66]([CH3:67])=[O:68].[ClH:29].[K+:54].[K+:55].[K+:56].[OH2:69].[P:49]([O-:50])([O-:51])([O-:52])=[O:53]>>[c:2]1(-[c:35]2[cH:34][c:33]([CH2:32][N:31]([CH3:30])[CH3:48])[cH:38][cH:37][cH:36]2)[cH:3][c:4]([C:16](=[O:17])[NH:18][CH2:19][c:20]2[c:21](=[O:28])[nH:22][c:23]([CH3:27])[cH:24][c:25]2[CH3:26])[c:5]2[c:6]([CH3:15])[cH:7][n:8]([CH:11]([CH3:12])[CH2:13][CH3:14])[c:9]2[cH:10]1