HRID89019

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID15908

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

C8H17N3

HCID81531

Diisopropylethylamine

C8H19N

结构：O=C(O)CCN1CCC(OC(=O)Nc2ccccc2-c2ccccc2)CC1

HCID21880607

未命名化合物

HCID21880609

[3-(Aminomethyl)phenyl]methanol

C8H11NO

PRODUCTS

生成物

结构：O=C(CCN1CCC(OC(=O)Nc2ccccc2-c2ccccc2)CC1)NCc1cccc(CO)c1

HCID59340333

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7ab69a9c7a30415184bc81c38ee4e934
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:47][CH2:48][N:49]=[C:50]=[N:51][CH2:52][CH2:53][CH2:54][N:55]([CH3:56])[CH3:57].[CH3:61][N:62]([c:63]1[cH:64][cH:65][n:66][cH:67][cH:68]1)[CH3:69].[CH:28]([N:29]([CH2:30][CH3:31])[CH:32]([CH3:33])[CH3:34])([CH3:35])[CH3:36].[Cl:58][CH2:59][Cl:60].[NH2:37][CH2:38][c:39]1[cH:40][c:41]([CH2:42][OH:43])[cH:44][cH:45][cH:46]1.[c:1]1(-[c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:2]([NH:7][C:8](=[O:9])[O:10][CH:11]2[CH2:12][CH2:13][N:14]([CH2:17][CH2:18][C:19](=[O:20])[OH:21])[CH2:15][CH2:16]2)[cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:2]([NH:7][C:8](=[O:9])[O:10][CH:11]2[CH2:12][CH2:13][N:14]([CH2:17][CH2:18][C:19](=[O:21])[NH:37][CH2:38][c:39]3[cH:40][c:41]([CH2:42][OH:43])[cH:44][cH:45][cH:46]3)[CH2:15][CH2:16]2)[cH:3][cH:4][cH:5][cH:6]1