HRID2154872

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID8857

Ethyl Acetate

C4H8O2

HCID10387

Benzyl chloroformate

C8H7ClO2

HCID152445

N-Methyl-2,3,4,9-tetrahydro-1H-carbazol-3-amine

C13H16N2

HCID11571804

4-(Methylamino)cyclohexan-1-ol

C7H15NO

HCID20760632

4-(Methylamino)cyclohexan-1-one

C7H13NO

PRODUCTS

产物

HCID69197783

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-9a9109d756d74100ade1cf1be22c44a5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

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