HRID313381

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID23478

Ethane, 1-chloro-1-ethoxy-

C4H9ClO

HCID23457829

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCCCCCCCCCNc1ccc(C(=O)OC(C)OCC)cc1

HCID23457774

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f377952d6ea24556b709b127d6fd09d4
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

[CH2:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[NH:23][c:24]1[cH:25][cH:26][c:27]([C:28](=[O:29])[O-:30])[cH:31][cH:32]1.[CH3:34][N:35]([P:36]([N:37]([CH3:38])[CH3:39])([N:40]([CH3:41])[CH3:42])=[O:43])[CH3:44].[Cl:1][CH:2]([CH3:3])[O:4][CH2:5][CH3:6].[Na+:33].[OH2:45]>>[CH:2]([CH3:3])([O:4][CH2:5][CH3:6])[O:30][C:28]([c:27]1[cH:26][cH:25][c:24]([NH:23][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[cH:32][cH:31]1)=[O:29]