HRID95210

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID12019

3-Pentanamine

C5H13N

结构：Cc1ccc(S(=O)(=O)OCc2noc(C(CCCC3CCCCC3)CC(=O)OC(C)(C)C)n2)cc1

HCID178427704

未命名化合物

PRODUCTS

生成物

结构：CCC(CC)NCc1noc(C(CCCC2CCCCC2)CC(=O)OC(C)(C)C)n1

HCID21305082

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-59c397a3a8de47e38faa60f94f1047b9
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

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