Hydrochloric Acid → HCID 72243935, compound
Reaction equation
[CH2:50]1[O:51][CH2:52][CH2:53][O:54][CH2:55]1.[Cl:1][c:2]1[c:3]([F:49])[c:4]([CH:8]2[CH:9]([C:28](=[O:29])[N:30]3[CH2:31][CH2:32][N:33]([CH2:36][C:37](=[O:38])[NH:39][CH2:40][CH2:41][CH:42]4[O:43][C:44]([CH3:47])([CH3:48])[O:45][CH2:46]4)[CH2:34][CH2:35]3)[NH:10][CH:11]([CH2:23][C:24]([CH3:25])([CH3:26])[CH3:27])[C:12]2([C:13]#[N:14])[c:15]2[c:16]([F:22])[cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[cH:5][cH:6][cH:7]1.[ClH:56]>>[Cl:1][c:2]1[c:3]([F:49])[c:4]([CH:8]2[CH:9]([C:28](=[O:29])[N:30]3[CH2:31][CH2:32][N:33]([CH2:36][C:37](=[O:38])[NH:39][CH2:40][CH2:41][CH:42]([OH:43])[CH2:46][OH:45])[CH2:34][CH2:35]3)[NH:10][CH:11]([CH2:23][C:24]([CH3:25])([CH3:26])[CH3:27])[C:12]2([C:13]#[N:14])[c:15]2[c:16]([F:22])[cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[cH:5][cH:6][cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-16b350c7adef43c99253f97f9d93bcd4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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