Hydrochloric Acid → HCID 178446803, compound
Reaction equation
[C:41]([O:42][CH:43]([C:44]([CH3:45])([CH3:46])[CH3:47])[CH2:48][n:49]1[cH:50][n:51][c:52]2[c:53]1[cH:54][c:55]([Cl:59])[c:56]([Cl:58])[cH:57]2)([O:60][c:62]1[cH:63][cH:64][c:65]([N+:66]([O-:67])=[O:68])[cH:69][cH:70]1)=[O:61].[CH3:80][N:81]([CH3:82])[CH:83]=[O:84].[CH:71]([N:72]([CH:73]([CH3:74])[CH3:75])[CH2:76][CH3:77])([CH3:78])[CH3:79].[ClH:1].[ClH:21].[NH2:22][CH:23]([CH2:24][CH2:25][CH2:26][CH3:27])[CH:28]([OH:29])[CH2:30][NH:31][S:32]([c:33]1[cH:34][cH:35][cH:36][cH:37][n:38]1)(=[O:39])=[O:40].[NH2:2][CH:3]([CH:4]([CH2:5][NH:6][S:7](=[O:8])(=[O:9])[c:10]1[n:11][cH:12][cH:13][cH:14][cH:15]1)[OH:16])[CH2:17][CH2:18][CH2:19][CH3:20]>>[NH:2]([CH:3]([CH:4]([CH2:5][NH:6][S:7](=[O:8])(=[O:9])[c:10]1[n:11][cH:12][cH:13][cH:14][cH:15]1)[OH:16])[CH2:17][CH2:18][CH2:19][CH3:20])[C:41]([O:42][CH:43]([C:44]([CH3:45])([CH3:46])[CH3:47])[CH2:48][n:49]1[cH:50][n:51][c:52]2[c:53]1[cH:54][c:55]([Cl:59])[c:56]([Cl:58])[cH:57]2)=[O:60]Participants
6
Sources & evidence
- ORD record
- ord-121ae235eeff4e1cbe6b6504cc767455
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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