HRID99724

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID98089

1-(1-Naphthyl)ethylamine

C12H13N

HCID2724942

未命名化合物

结构：O=CC1CCN(C(=O)C(F)(F)F)CC1c1cccc(F)c1

HCID178519762

未命名化合物

PRODUCTS

生成物

结构：CC(NCC1CCN(C(=O)C(F)(F)F)CC1c1cccc(F)c1)c1cccc2ccccc12

HCID72536203

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-114ee8409c37487ba71e09ebbdd45326
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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