HRID205711

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

HCID5148299

未命名化合物

HCID14795870

4-Bromo-2,3-dihydro-1H-isoindole

C8H8BrN

PRODUCTS

生成物

结构：COC(=O)C1CC(OC(=O)N2Cc3cccc(Br)c3C2)CN1C(=O)OC(C)(C)C

HCID66888144

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-52c1139801a04057bd39d393cc603b32
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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