HRID801688

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID23508315

[2-(2-Methylanilino)-1,3-benzoxazol-6-yl]acetic acid

C16H14N2O3

结构：COC(=O)C1CCC(OCC2CCCN2C(=O)OC(C)(C)C)CC1

HCID23512198

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C1CCC(OCC2CCCN2C(=O)Cc2ccc3nc(Nc4ccccc4C)oc3c2)CC1

HCID178498234

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b37230d7d7c84376871da29e1367043f
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([O:2][C:6](=[O:7])[N:8]1[CH:9]([CH2:13][O:14][CH:15]2[CH2:16][CH2:17][CH:18]([C:21](=[O:22])[O:23][CH3:24])[CH2:19][CH2:20]2)[CH2:10][CH2:11][CH2:12]1)([CH3:3])([CH3:4])[CH3:5].[CH2:63]([Cl:64])[Cl:65].[CH3:25][c:26]1[c:27]([NH:32][c:33]2[o:34][c:35]3[c:36]([n:37]2)[cH:38][cH:39][c:40]([CH2:42][C:43]([OH:44])=[O:45])[cH:41]3)[cH:28][cH:29][cH:30][cH:31]1.[CH3:56][CH2:57][N:58]([CH2:59][CH3:60])[CH2:61][CH3:62].[OH2:66].[OH:46][n:47]1[c:48]2[c:49]([cH:50][cH:51][cH:52][cH:53]2)[n:54][n:55]1>>[C:6](=[O:7])([N:8]1[CH:9]([CH2:13][O:14][CH:15]2[CH2:16][CH2:17][CH:18]([C:21](=[O:22])[O:23][CH3:24])[CH2:19][CH2:20]2)[CH2:10][CH2:11][CH2:12]1)[CH2:42][c:40]1[cH:39][cH:38][c:36]2[c:35]([o:34][c:33]([NH:32][c:27]3[c:26]([CH3:25])[cH:31][cH:30][cH:29][cH:28]3)[n:37]2)[cH:41]1