HRID162175

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID123498

Phenol, 2-chloro-5-(trifluoromethyl)-

C7H4ClF3O

HCID220568

Diethyl azodicarboxylate

C6H10N2O4

HCID69799429

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NCCC(Oc1cc(C(F)(F)F)ccc1Cl)c1cccnc1

HCID86759695

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9f345d12f8f349a28b386eccca319554
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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