HRID676959

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID101174

3-(4-chlorophenoxy)-2-hydroxypropanoic acid

C9H9ClO4

结构：CN(C)[P+](On1nnc2ccccc21)(N(C)C)N(C)C

HCID124335

Benzotriazol-1-yloxy-tris(dimethylamino)phosphonium

C12H22N6OP+

HCID11470524

未命名化合物

PRODUCTS

生成物

结构：C#CCOc1ccc(CCNC(=O)C(O)COc2ccc(Cl)cc2)cc1OC

HCID11750051

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-38da9bbab66047a984598ed5927fa85b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH3:2][O:3][c:4]1[cH:5][c:6]([CH2:14][CH2:15][NH2:16])[cH:7][cH:8][c:9]1[O:10][CH2:11][C:12]#[CH:13].[CH3:67][N:68]([CH3:69])[CH:70]=[O:71].[CH:17]([N:18]([CH2:19][CH3:20])[CH:21]([CH3:22])[CH3:23])([CH3:24])[CH3:25].[Cl:26][c:27]1[cH:28][cH:29][c:30]([O:31][CH2:32][CH:33]([C:34](=[O:35])[OH:36])[OH:37])[cH:38][cH:39]1.[ClH:1].[P-:40]([F:41])([F:42])([F:43])([F:44])([F:45])[F:46].[n:47]1([O:48][P+:49]([N:50]([CH3:51])[CH3:52])([N:53]([CH3:54])[CH3:55])[N:56]([CH3:57])[CH3:58])[c:59]2[cH:60][cH:61][cH:62][cH:63][c:64]2[n:65][n:66]1>>[CH3:2][O:3][c:4]1[cH:5][c:6]([CH2:14][CH2:15][NH:16][C:34]([CH:33]([CH2:32][O:31][c:30]2[cH:29][cH:28][c:27]([Cl:26])[cH:39][cH:38]2)[OH:37])=[O:35])[cH:7][cH:8][c:9]1[O:10][CH2:11][C:12]#[CH:13]