HRID137759

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID3283

Diethyl Ether

C4H10O

HCID6365

1,1-Dichloroethane

C2H4Cl2

HCID7504

Benzylamine

C7H9N

HCID285865

2,3,4,9-tetrahydro-1H-carbazol-1-one

C12H11NO

HCID2724942

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

HCID11738490

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4fb5b15b475b406a9fe730ebbf142a5e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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