HRID1232989

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID2757234

未命名化合物

结构：CC(C)(C)OC(=O)NC1CCC(NC(=O)Oc2ccccc2)CC1

HCID67022954

(4-tert-Butoxycarbonylamino-cyclohexyl)-carbamic acid phenyl ester

C18H26N2O4

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1CCC(NC(=O)N2CCC(NC(=O)OC(C)(C)C)C2)CC1

HCID67023871

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-320abf67b8be4f2a9cd0b6a3b1caf043
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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