HRID692290

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7972

4-Methylmorpholine

C5H11NO

HCID8028

Tetrahydrofuran

C4H8O

HCID26255

Tetrafluoroborate

BF4-

HCID130500

未命名化合物

HCID2762872

5-chloropyridine-2-carboxylic Acid

C6H4ClNO2

结构：CC(C)(C)OC(=O)N1C(CCc2ccc(N)cc2)COC1(C)C

HCID66705808

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1C(CCc2ccc(NC(=O)c3ccc(Cl)cn3)cc2)COC1(C)C

HCID67151605

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-adf447de04474b9ca1b617978f1e8b39
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

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