HRID300595

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID7972

4-Methylmorpholine

C5H11NO

HCID8028

Tetrahydrofuran

C4H8O

HCID62365

Isobutyl chloroformate

C5H9ClO2

HCID392871

1-(tert-Butoxycarbonyl)-4-piperidinecarboxylic acid

C11H19NO4

HCID13365884

2-Amino-1-[3-(trifluoromethyl)phenyl]ethan-1-one

C9H8F3NO

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(C(=O)NCC(=O)c2cccc(C(F)(F)F)c2)CC1

HCID57751897

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-098067170cdb45c3a67b8f77c941c1b4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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