HRID92974

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID18677746

Phenylmethyl N-methyl-N-4-piperidinylcarbamate

C14H20N2O2

结构：CCOc1cc(Br)ccc1-c1nc2c(c(C3CCCCC3)nn2C)c(=O)[nH]1

HCID136005963

未命名化合物

PRODUCTS

生成物

结构：CCOc1cc(N2CCC(N(C)C(=O)OCc3ccccc3)CC2)ccc1-c1nc2c(c(C3CCCCC3)nn2C)c(=O)[nH]1

HCID136333210

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6469cb8accaf4691b47e1311b6bfa27a
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

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