HRID299979

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID92127

3-Iodo-1,2-propanediol

C3H7IO2

HCID20330969

4-[13-(4-Chlorophenyl)-12-tridecynylamino]benzoic acid

C26H32ClNO2

PRODUCTS

产物

HCID20330955

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-e32ed7e429744fa783433a08af6c898d
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

[CH3:39][N:40]([P:41]([N:42]([CH3:43])[CH3:44])([N:45]([CH3:46])[CH3:47])=[O:48])[CH3:49].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][NH:21][c:22]2[cH:23][cH:24][c:25]([C:26](=[O:27])[OH:28])[cH:29][cH:30]2)[cH:6][cH:7]1.[I:33][CH2:34][CH:35]([CH2:36][OH:37])[OH:38].[Na+:32].[OH-:31].[OH2:50]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][NH:21][c:22]2[cH:23][cH:24][c:25]([C:26](=[O:27])[O:28][CH2:34][CH:35]([CH2:36][OH:37])[OH:38])[cH:29][cH:30]2)[cH:6][cH:7]1