1,4-Dioxane → HCID 21698921, compound
Reaction equation
[NH2:1][c:2]1[c:3]([N:15]2[C:16](=[O:25])[C:17]3=[C:22]([CH2:21][CH2:20][CH2:19][CH2:18]3)[C:23]2=[O:24])[c:4]([F:14])[cH:5][c:6]2[c:7]1[N:8]([CH3:13])[C:9](=[O:12])[CH2:10][O:11]2.[O:39]1[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1.[cH:26]1[c:27]([C:36](=[O:37])[Cl:38])[cH:28][cH:29][c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]12>>[NH:1]([c:2]1[c:3]([N:15]2[C:16](=[O:25])[C:17]3=[C:22]([CH2:21][CH2:20][CH2:19][CH2:18]3)[C:23]2=[O:24])[c:4]([F:14])[cH:5][c:6]2[c:7]1[N:8]([CH3:13])[C:9](=[O:12])[CH2:10][O:11]2)[C:36]([c:27]1[cH:26][c:35]2[c:30]([cH:29][cH:28]1)[cH:31][cH:32][cH:33][cH:34]2)=[O:37]Participants
4
Sources & evidence
- ORD record
- ord-e48f1890fc1246ffa7135799d13a78ab
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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