1,4-Dioxane → HCID 58863820, compound
Reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([NH:9][c:10]2[n:11][c:12]([N:19]3[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]3)[n:13][c:14]([N:16]([CH3:17])[CH3:18])[cH:15]2)[cH:6][cH:7][cH:8]1.[CH:25]([N:26]([CH2:27][CH3:28])[CH:29]([CH3:30])[CH3:31])([CH3:32])[CH3:33].[Cl:34][CH2:35][c:36]1[cH:37][c:38]([O:42][CH3:43])[cH:39][cH:40][cH:41]1.[O:44]1[CH2:45][CH2:46][O:47][CH2:48][CH2:49]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([NH:9][c:10]2[n:11][c:12]([N:19]3[CH2:20][CH2:21][N:22]([CH2:35][c:36]4[cH:37][c:38]([O:42][CH3:43])[cH:39][cH:40][cH:41]4)[CH2:23][CH2:24]3)[n:13][c:14]([N:16]([CH3:17])[CH3:18])[cH:15]2)[cH:6][cH:7][cH:8]1Participants
5
Sources & evidence
- ORD record
- ord-91d6c7482c2a42cc9c17bbcd2749b60a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…