HRID815175

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID6342

Acetonitrile

C2H3N

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID4641409

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

C10H15N6O+

HCID14977845

未命名化合物

HCID178497858

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(C(C)NC(=O)c2cccc3c2N(C(=O)OC(C)(C)C)CC3)cc1

HCID143593195

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2a0decccf60d44618cbc6fca5844fa0c
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[cH:12][cH:13][cH:14][c:15]([C:17](=[O:18])[OH:19])[c:16]21.[CH3:45][O:46][C:47](=[O:48])[c:49]1[cH:50][cH:51][c:52]([CH:55]([CH3:56])[NH3+:57])[cH:53][cH:54]1.[CH3:67][C:68]#[N:69].[CH:58]([N:59]([CH2:60][CH3:61])[CH:62]([CH3:63])[CH3:64])([CH3:65])[CH3:66].[Cl-:44].[P-:20]([F:21])([F:22])([F:23])([F:24])([F:25])[F:26].[n:27]1([O:28][C:29]([N:30]([CH3:31])[CH3:32])=[N+:33]([CH3:34])[CH3:35])[c:36]2[n:37][cH:38][cH:39][cH:40][c:41]2[n:42][n:43]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[cH:12][cH:13][cH:14][c:15]([C:17](=[O:18])[NH:57][CH:55]([c:52]3[cH:51][cH:50][c:49]([C:47]([O:46][CH3:45])=[O:48])[cH:54][cH:53]3)[CH3:56])[c:16]21