HRID315196

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID245438

未命名化合物

HCID269722

1-(4-Methoxyphenyl)piperazine

C11H16N2O

HCID854052

未命名化合物

HCID22915180

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(N2CCN(C(=O)C(CC(C)C)C3OC(C)(C)OC3=O)CC2)cc1

HCID178491992

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-34f48146ae4742e7a243917e676128e6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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