Chloride → HCID 23371869, compound
Reaction equation
[CH3:31][O:32][CH2:33][CH2:34][O:35][CH3:36].[CH3:37][CH2:38][OH:39].[Cl-:30].[Na+:29].[O:1]=[C:2]1[CH2:3][CH2:4][CH:5]([c:8]2[cH:9][cH:10][c:11]([NH2:12])[cH:13][cH:14]2)[CH2:6][CH2:7]1.[OH2:28].[c:15]1([CH3:16])[cH:17][cH:18][c:19]([S:20](=[O:22])(=[O:23])[CH2:24][N+:25]#[C-:21])[cH:26][cH:27]1>>[CH:2]1([C:24]#[N:25])[CH2:3][CH2:4][CH:5]([c:8]2[cH:9][cH:10][c:11]([NH2:12])[cH:13][cH:14]2)[CH2:6][CH2:7]1Participants
8
Sources & evidence
- ORD record
- ord-9e4ed9c14c624565a863e1bf0e81af5a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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