Bromide ion → HCID 57666057, compound
Reaction equation
[Br-:53].[C:47](=[O:48])([O-:49])[O-:50].[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][CH:7]([CH3:8])[CH3:9])[c:10]1[cH:11][c:12](-[c:26]2[cH:27][cH:28][c:29]([C:32]([F:33])([F:34])[F:35])[cH:30][cH:31]2)[cH:13][c:14]([CH:16]2[NH:17][CH:18]([C:22]([F:23])([F:24])[F:25])[CH2:19][CH2:20][CH2:21]2)[cH:15]1)=[O:36].[CH2:55]([N+:56]([CH2:57][CH2:58][CH2:59][CH3:60])([CH2:61][CH2:62][CH2:63][CH3:64])[CH2:65][CH2:66][CH2:67][CH3:68])[CH2:69][CH2:70][CH3:71].[CH3:37][O:38][c:39]1[cH:40][cH:41][c:42]([CH2:43][Br:44])[cH:45][cH:46]1.[CH:72]([N:73]([CH2:74][CH3:75])[CH:76]([CH3:77])[CH3:78])([CH3:79])[CH3:80].[Cs+:51].[Cs+:52].[I-:54]>>[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][CH:7]([CH3:8])[CH3:9])[c:10]1[cH:11][c:12](-[c:26]2[cH:27][cH:28][c:29]([C:32]([F:33])([F:34])[F:35])[cH:30][cH:31]2)[cH:13][c:14]([CH:16]2[N:17]([CH2:43][c:42]3[cH:41][cH:40][c:39]([O:38][CH3:37])[cH:46][cH:45]3)[CH:18]([C:22]([F:23])([F:24])[F:25])[CH2:19][CH2:20][CH2:21]2)[cH:15]1)=[O:36]Participants
9
Sources & evidence
- ORD record
- ord-c46b4023400d44888789335805792e37
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
Loading…