1,4-Dioxane → HCID 59175856, compound
Reaction equation
[NH2:1][c:2]1[c:3]([F:34])[cH:4][c:5]([C:9](=[O:10])[N:11]2[CH2:12][CH2:13][N:14]([CH2:17][c:18]3[cH:19][cH:20][c:21]([C:24]([C:25]([F:26])([F:27])[F:28])([C:29]([F:30])([F:31])[F:32])[OH:33])[cH:22][cH:23]3)[CH2:15][CH2:16]2)[cH:6][c:7]1[F:8].[O:51]1[CH2:52][CH2:53][O:54][CH2:55][CH2:56]1.[n:35]1[cH:36][cH:37][c:38]([NH:41][C:42]([O:43][c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)=[O:44])[cH:39][cH:40]1>>[NH:1]([c:2]1[c:3]([F:34])[cH:4][c:5]([C:9](=[O:10])[N:11]2[CH2:12][CH2:13][N:14]([CH2:17][c:18]3[cH:19][cH:20][c:21]([C:24]([C:25]([F:26])([F:27])[F:28])([C:29]([F:30])([F:31])[F:32])[OH:33])[cH:22][cH:23]3)[CH2:15][CH2:16]2)[cH:6][c:7]1[F:8])[C:42]([NH:41][c:38]1[cH:37][cH:36][n:35][cH:40][cH:39]1)=[O:43]Participants
4
Sources & evidence
- ORD record
- ord-810f198193184e22adaa5e2628108247
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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