HRID675736

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

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+

HCID59314088

未命名化合物

HCID59314176

Ethyl 2-amino-2,3-dihydro-5,6-dimethyl-1H-indene-2-carboxylate

C14H19NO2

PRODUCTS

生成物

结构：CCOC(=O)C1(NC(=O)c2cccc(C)c2OC(C)C)Cc2cc(C)c(C)cc2C1

HCID59314221

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-71f7961f0db64d16a365b6119186a2fe
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

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