Hydrochloric Acid → [4-(3,6-Dimethyl-4,10-dihydro-3H-2,3,4,9-tetraaza-benzo[f]azulene-9-carbonyl)-cyclohexylmethyl]-carbamic Acid 4-nitro-benzyl Ester
Reaction equation
[CH2:45]([N:46]([CH2:47][CH3:48])[CH2:49][CH3:50])[CH3:51].[Cl:1][C:2](=[O:3])[O:4][CH2:5][c:6]1[cH:7][cH:8][c:9]([N+:12](=[O:13])[O-:14])[cH:10][cH:11]1.[Cl:42][CH2:43][Cl:44].[ClH:15].[NH2:16][CH2:17][CH:18]1[CH2:19][CH2:20][CH:21]([C:24](=[O:25])[N:26]2[c:27]3[c:28]([cH:37][c:38]([CH3:41])[cH:39][cH:40]3)[NH:29][c:30]3[n:31]([CH3:36])[n:32][cH:33][c:34]3[CH2:35]2)[CH2:22][CH2:23]1>>[C:2](=[O:3])([O:4][CH2:5][c:6]1[cH:7][cH:8][c:9]([N+:12](=[O:13])[O-:14])[cH:10][cH:11]1)[NH:16][CH2:17][CH:18]1[CH2:19][CH2:20][CH:21]([C:24](=[O:25])[N:26]2[c:27]3[c:28]([cH:37][c:38]([CH3:41])[cH:39][cH:40]3)[NH:29][c:30]3[n:31]([CH3:36])[n:32][cH:33][c:34]3[CH2:35]2)[CH2:22][CH2:23]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-7d0d21d66b9c4e4eb8c3fe072cf282aa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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