HRID675882

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1032

未命名化合物

结构：FC(F)(F)Oc1cccc(COC2CCNCC2C(c2ccccc2)c2ccccc2)c1

HCID69060299

未命名化合物

PRODUCTS

生成物

结构：CCC(=O)N1CCC(OCc2cccc(OC(F)(F)F)c2)C(C(c2ccccc2)c2ccccc2)C1

HCID69058842

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-17a5bd8f708a4183944bdc3abe78e9ed
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

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