HRID702271

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID20394

2-(Chloromethyl)quinoline

C10H8ClN

HCID10659962

未命名化合物

PRODUCTS

生成物

结构：CCCCC1(CCCC)CCc2c(OCc3ccc4ccccc4n3)cccc2C1=O

HCID10549790

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f5f0b980343642df94f559f3f9adbfb7
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

[C:33](=[O:34])([O-:35])[O-:36].[CH2:1]([CH2:2][CH2:3][CH3:4])[C:5]1([CH2:17][CH2:18][CH2:19][CH3:20])[C:6](=[O:16])[c:7]2[cH:8][cH:9][cH:10][c:11]([OH:15])[c:12]2[CH2:13][CH2:14]1.[CH3:40][N:41]([CH3:42])[CH:43]=[O:44].[Cl:21][CH2:22][c:23]1[n:24][c:25]2[cH:26][cH:27][cH:28][cH:29][c:30]2[cH:31][cH:32]1.[K+:37].[K+:38].[OH2:39]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[C:5]1([CH2:17][CH2:18][CH2:19][CH3:20])[C:6](=[O:16])[c:7]2[cH:8][cH:9][cH:10][c:11]([O:15][CH2:22][c:23]3[n:24][c:25]4[cH:26][cH:27][cH:28][cH:29][c:30]4[cH:31][cH:32]3)[c:12]2[CH2:13][CH2:14]1