HRID951453

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID3283

Diethyl Ether

C4H10O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID19039502

4-Methoxy-3-(3-methoxypropoxy)benzoic acid

C12H16O5

结构：CC(C)NCC1CN(Cc2ccccc2)CC1CN(C(=O)OC(C)(C)C)C(C)C

HCID68618326

未命名化合物

PRODUCTS

生成物

结构：COCCCOc1cc(C(=O)N(CC2CN(Cc3ccccc3)CC2CN(C(=O)OC(C)(C)C)C(C)C)C(C)C)ccc1OC

HCID68617611

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4a9a194abb494612b5dcb9f674eeb888
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH:8]([CH3:9])[CH3:10])[CH2:11][CH:12]1[CH2:13][N:14]([CH2:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[CH2:15][CH:16]1[CH2:17][NH:18][CH:19]([CH3:20])[CH3:21])=[O:29].[CH2:47]([N:48]([CH2:49][CH3:50])[CH2:51][CH3:52])[CH3:53].[CH3:30][O:31][c:32]1[c:33]([O:41][CH2:42][CH2:43][CH2:44][O:45][CH3:46])[cH:34][c:35]([C:36](=[O:37])[OH:38])[cH:39][cH:40]1.[CH3:55][N:56]([c:57]1[cH:58][cH:59][n:60][cH:61][cH:62]1)[CH3:63].[CH3:69][CH2:70][O:71][CH2:72][CH3:73].[O:64]=[CH:65][N:66]([CH3:67])[CH3:68].[OH2:54]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH:8]([CH3:9])[CH3:10])[CH2:11][CH:12]1[CH2:13][N:14]([CH2:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[CH2:15][CH:16]1[CH2:17][N:18]([CH:19]([CH3:20])[CH3:21])[C:36]([c:35]1[cH:34][c:33]([O:41][CH2:42][CH2:43][CH2:44][O:45][CH3:46])[c:32]([O:31][CH3:30])[cH:40][cH:39]1)=[O:37])=[O:29]