HRID673438

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7972

4-Methylmorpholine

C5H11NO

HCID19709

3,3-Dimethylbutylamine

C6H15N

HCID62365

Isobutyl chloroformate

C5H9ClO2

结构：O=C(O)CN1C(=O)C2(COc3cc4c(cc32)CCO4)c2ccccc21

HCID59263485

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)CCNC(=O)CN1C(=O)C2(COc3cc4c(cc32)CCO4)c2ccccc21

HCID59352706

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2f43f88b5dff45d7a0cb353ff0bf382f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH2:26]([O:27][C:28]([Cl:29])=[O:30])[CH:31]([CH3:32])[CH3:33].[CH3:34][N:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1.[CH3:41][C:42]([CH2:43][CH2:44][NH2:45])([CH3:46])[CH3:47].[Cl:48][CH2:49][Cl:50].[O:1]=[C:2]1[N:3]([CH2:22][C:23](=[O:24])[OH:25])[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[C:10]12[c:11]1[c:12]([cH:15][c:16]3[c:20]([cH:21]1)[CH2:19][CH2:18][O:17]3)[O:13][CH2:14]2>>[O:1]=[C:2]1[N:3]([CH2:22][C:23](=[O:24])[NH:45][CH2:44][CH2:43][C:42]([CH3:41])([CH3:46])[CH3:47])[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[C:10]12[c:11]1[c:12]([cH:15][c:16]3[c:20]([cH:21]1)[CH2:19][CH2:18][O:17]3)[O:13][CH2:14]2