HRID1120917

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID222

Ammonia gas

H3N

HCID7034

4,4'-Dichlorobenzophenone

C13H8Cl2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8037

N,N,N',N'-Tetramethylethylenediamine

C6H16N2

HCID21321308

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

结构：COCn1c(C(O)(c2ccc(Cl)cc2)c2ccc(Cl)cc2)nc(C)c1C

HCID12433910

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d803e92b01f74db5808760d1901bea15
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

[CH3:16][N:17]([CH2:18][CH2:19][N:20]([CH3:21])[CH3:22])[CH3:23].[CH3:6][O:7][CH2:8][n:9]1[cH:10][n:11][c:12]([CH3:15])[c:13]1[CH3:14].[Cl:24][c:25]1[cH:26][cH:27][c:28]([C:29](=[O:30])[c:31]2[cH:32][cH:33][c:34]([Cl:37])[cH:35][cH:36]2)[cH:38][cH:39]1.[Li:1][CH2:2][CH2:3][CH2:4][CH3:5].[NH3:40].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1>>[CH3:6][O:7][CH2:8][n:9]1[c:10]([C:29]([c:28]2[cH:27][cH:26][c:25]([Cl:24])[cH:39][cH:38]2)([OH:30])[c:31]2[cH:32][cH:33][c:34]([Cl:37])[cH:35][cH:36]2)[n:11][c:12]([CH3:15])[c:13]1[CH3:14]