HRID207245

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

Dimethylformamide

C3H7NO

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID2857447

未命名化合物

反应SMILES：O=C(O)C1CC(F)(F)CN1C(=O)OCc1ccccc1

HCID21922655

未命名化合物

PRODUCTS

产物

反应SMILES：O=C(NC1C2CC3CC1CC(O)(C3)C2)C1CC(F)(F)CN1C(=O)OCc1ccccc1

HCID66773600

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ae77d1d2a7c44fd8a1c38eff2a7b662d
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

[CH2:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[O:20][C:21](=[O:22])[N:23]1[CH:24]([C:30](=[O:31])[OH:32])[CH2:25][C:26]([F:28])([F:29])[CH2:27]1.[CH3:43][CH2:44][N:45]=[C:46]=[N:47][CH2:48][CH2:49][CH2:50][N:51]([CH3:52])[CH3:53].[NH2:1][CH:2]1[CH:3]2[CH2:4][C:5]3([OH:12])[CH2:6][CH:7]([CH2:8][CH:9]1[CH2:10]3)[CH2:11]2.[O:54]=[CH:55][N:56]([CH3:57])[CH3:58].[OH2:59].[OH:33][n:34]1[c:35]2[c:36]([cH:37][cH:38][cH:39][cH:40]2)[n:41][n:42]1>>[NH:1]([CH:2]1[CH:3]2[CH2:4][C:5]3([OH:12])[CH2:6][CH:7]([CH2:8][CH:9]1[CH2:10]3)[CH2:11]2)[C:30]([CH:24]1[N:23]([C:21]([O:20][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)=[O:22])[CH2:27][C:26]([F:28])([F:29])[CH2:25]1)=[O:31]