Hydrochloric Acid → N-[(1RS,2SR)-1-(4-tert-butylbenzyl)-2-(3-chlorophenyl)-2-hydroxyethyl]-6,7-dihydro-5H-benzo[a][7]annulene-1-carboxamide
Reaction equation
[CH2:38]([N:39]=[C:40]=[N:41][CH2:42][CH2:43][CH2:44][N:45]([CH3:46])[CH3:47])[CH3:48].[CH3:60][C:61]#[N:62].[ClH:37].[NH2:1][CH:2]([CH:3]([OH:4])[c:5]1[cH:6][c:7]([Cl:11])[cH:8][cH:9][cH:10]1)[CH2:12][c:13]1[cH:14][cH:15][c:16]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:17][cH:18]1.[OH2:49].[OH2:63].[OH:50][n:51]1[c:52]2[cH:53][cH:54][cH:55][cH:56][c:57]2[n:58][n:59]1.[c:23]1([C:34](=[O:35])[OH:36])[cH:24][cH:25][cH:26][c:27]2[c:28]1[CH:29]=[CH:30][CH2:31][CH2:32][CH2:33]2>>[NH:1]([CH:2]([CH:3]([OH:4])[c:5]1[cH:6][c:7]([Cl:11])[cH:8][cH:9][cH:10]1)[CH2:12][c:13]1[cH:14][cH:15][c:16]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:17][cH:18]1)[C:34]([c:23]1[cH:24][cH:25][cH:26][c:27]2[c:28]1[CH:29]=[CH:30][CH2:31][CH2:32][CH2:33]2)=[O:35]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-9954a5506fb44d2f88bd8d344468ba26
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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