HRID2328909

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6422

未命名化合物

HCID7412

Benzoyl chloride

C7H5ClO

HCID81531

Diisopropylethylamine

C8H19N

HCID58893165

未命名化合物

PRODUCTS

生成物

结构：O=C(c1ccccc1)N1CCC2(CC1)CCN(C1CCCCC1)C2=O

HCID16739440

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-05daa323d43e425db30f98632136888b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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