HRID683237

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID10426

Carbonochloridic acid, trichloromethyl ester

C2Cl4O2

HCID253298

2-Furanmethanamine, tetrahydro-

C5H11NO

HCID17862347

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(Oc2ccc(Cl)cc2C(F)(F)F)nn1C(=O)NCC1CCCO1

HCID17862366

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-13175d920923436c91a0e9f687967f79
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

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