Hydrochloric Acid → HCID 66890859, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[n:5]1[n:6][cH:7][cH:8][c:9]1[NH:10][c:11]1[cH:12][cH:13][cH:14][c:15]([CH2:17][C:18]2([C:37](=[O:38])[OH:39])[CH2:19][CH2:20][N:21]([C:24]([c:25]3[c:26]([F:35])[c:27]([C:31]([F:32])([F:33])[F:34])[cH:28][cH:29][cH:30]3)=[O:36])[CH2:22][CH2:23]2)[n:16]1.[C:40]([NH:41][NH2:42])(=[O:43])[O:44][C:45]([CH3:46])([CH3:47])[CH3:48].[C:61](=[O:62])([OH:63])[O-:64].[CH3:50][N:51]([CH3:52])[CH2:53][CH2:54][CH2:55][N:56]=[C:57]=[N:58][CH2:59][CH3:60].[CH:66]([Cl:67])([Cl:68])[Cl:69].[ClH:49].[Na+:65]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[n:5]1[n:6][cH:7][cH:8][c:9]1[NH:10][c:11]1[cH:12][cH:13][cH:14][c:15]([CH2:17][C:18]2([C:37](=[O:38])[NH:42][NH:41][C:40](=[O:43])[O:44][C:45]([CH3:46])([CH3:47])[CH3:48])[CH2:19][CH2:20][N:21]([C:24]([c:25]3[c:26]([F:35])[c:27]([C:31]([F:32])([F:33])[F:34])[cH:28][cH:29][cH:30]3)=[O:36])[CH2:22][CH2:23]2)[n:16]1Participants
8
Sources & evidence
- ORD record
- ord-ad9f8917dee94953a6a58cf4ba6b2795
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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