HRID1121310

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6115

Aniline

C6H7N

结构：COc1ccc(C2CCN(c3c(C)c(C)c4c(c3C)C(O)C(C)(C)O4)CC2)cc1OC

HCID67420698

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C2CCN(c3c(C)c(C)c4c(c3C)C(Nc3ccccc3)C(C)(C)O4)CC2)cc1OC

HCID10207226

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2da2a851a173469eaf04f59013f1f8c3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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