Hydrochloric Acid → Benzyl 4-isocyanato-2-methyl-5-(4-phenylphenyl)pentanoate
Reaction equation
[CH2:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[O:26][C:27]([CH:28]([CH2:29][CH:30]([CH2:31][c:32]1[cH:33][cH:34][c:35](-[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[cH:36][cH:37]1)[NH2:44])[CH3:45])=[O:46].[Cl:6][C:7]([Cl:8])([O:9][C:10](=[O:11])[O:12][C:13]([Cl:14])([Cl:15])[Cl:16])[Cl:17].[ClH:18].[Na+:5].[O-:1][C:2]([OH:3])=[O:4]>>[O:1]=[C:2]=[N:44][CH:30]([CH2:29][CH:28]([C:27]([O:26][CH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)=[O:46])[CH3:45])[CH2:31][c:32]1[cH:33][cH:34][c:35](-[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[cH:36][cH:37]1Participants
6
Sources & evidence
- ORD record
- ord-c877753326d644abb77b4ad3553cc105
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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