HRID116967

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7972

4-Methylmorpholine

C5H11NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID83692

Glycine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-

C8H15NO4

HCID571825

Methyl 2,3-diaminobenzoate

C8H10N2O2

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

PRODUCTS

生成物

结构：COC(=O)c1cccc(NC(=O)CN(C)C(=O)OC(C)(C)C)c1N

HCID58101623

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9bce8761aa3343f68ac91e7f5a912109
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:32](=[O:33])([O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[N:39]([CH3:40])[CH2:41][C:42](=[O:43])[OH:44].[CH3:1][N:2]1[CH2:3][CH2:4][O:5][CH2:6][CH2:7]1.[NH2:45][c:46]1[c:47]([C:48](=[O:49])[O:50][CH3:51])[cH:52][cH:53][cH:54][c:55]1[NH2:56].[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[OH2:62].[P-:8]([F:9])([F:10])([F:11])([F:12])([F:13])[F:14].[n:15]1([O:16][C:17]([N:18]([CH3:19])[CH3:20])=[N+:21]([CH3:22])[CH3:23])[c:24]2[n:25][cH:26][cH:27][cH:28][c:29]2[n:30][n:31]1>>[C:32](=[O:33])([O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[N:39]([CH3:40])[CH2:41][C:42](=[O:44])[NH:56][c:55]1[c:46]([NH2:45])[c:47]([C:48](=[O:49])[O:50][CH3:51])[cH:52][cH:53][cH:54]1