HRID1148598

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID971

Oxalic acid

C2H2O4

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID71081

Oxalic acid, ion(2-)

C2O4-2

HCID166653

Hydride

H-

HCID209291

1H-Pyrido(4,3-b)indole, 2,3,4,5-tetrahydro-2,8-dimethyl-

C13H16N2

HCID86634537

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc2c(c1)c1c(n2CC(O)c2cncc(C(F)(F)F)c2)CCN(C)C1

HCID57876056

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1aabaefb8ff9433aa77bd5dda530e148
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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