HRID104114

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID849

2-Piperidinecarboxylic acid

C6H11NO2

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID62365

Isobutyl chloroformate

C5H9ClO2

HCID309226

3-(benzyloxy)benzoic acid

C14H12O3

PRODUCTS

生成物

结构：O=C(O)C1CCCCN1C(=O)c1cccc(OCc2ccccc2)c1

HCID18367416

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1383fe79c6944a5bbb9c37f07b735ae0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][cH:16][cH:17]1.[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[Cl:18][C:19]([O:20][CH2:21][CH:22]([CH3:23])[CH3:24])=[O:25].[NH:26]1[CH:27]([C:32](=[O:33])[OH:34])[CH2:28][CH2:29][CH2:30][CH2:31]1.[Na+:39].[O-:35][C:36]([OH:37])=[O:38].[OH2:45]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([C:12](=[O:14])[N:26]2[CH:27]([C:32](=[O:33])[OH:34])[CH2:28][CH2:29][CH2:30][CH2:31]2)[cH:15][cH:16][cH:17]1