Oxalyl chloride → HCID 11540495, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[cH:15][c:16]([N:23]3[CH2:24][CH2:25][CH:26]([CH3:29])[CH2:27][CH2:28]3)[c:17]([N+:20]([O-:21])=[O:22])[cH:18][cH:19]2)[CH2:12][CH2:13]1.[C:30](#[N:31])[c:32]1[cH:33][cH:34][c:35]([C:37](=[O:38])[OH:39])[o:36]1.[CH:46]([N:47]([CH2:48][CH3:49])[CH:50]([CH3:51])[CH3:52])([CH3:53])[CH3:54].[Cl:40][C:41]([C:42]([Cl:43])=[O:44])=[O:45]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[cH:15][c:16]([N:23]3[CH2:24][CH2:25][CH:26]([CH3:29])[CH2:27][CH2:28]3)[c:17]([NH:20][C:37]([c:35]3[cH:34][cH:33][c:32]([C:30]#[N:31])[o:36]3)=[O:38])[cH:18][cH:19]2)[CH2:12][CH2:13]1Participants
5
Sources & evidence
- ORD record
- ord-295fa7eb166f41b0a539a82f4ace5773
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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