Water → HCID 9828564, compound
Reaction equation
[CH3:48][CH2:49][CH2:50][CH2:51][N+:52]([CH2:53][CH2:54][CH2:55][CH3:56])([CH2:57][CH2:58][CH2:59][CH3:60])[CH2:61][CH2:62][CH2:63][CH3:64].[Cl:1][c:2]1[c:3]([NH:40][C:41](=[O:42])[NH:43][CH:44]2[CH2:45][CH2:46]2)[cH:4][cH:5][c:6]([O:8][c:9]2[c:10]3[c:11]([n:12][cH:13][n:14]2)[n:15]([CH2:32][O:33][CH2:34][CH2:35][Si:36]([CH3:37])([CH3:38])[CH3:39])[c:16](-[c:18]2[cH:19][cH:20][c:21]([O:24][CH2:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31])[cH:22][cH:23]2)[cH:17]3)[cH:7]1.[F-:47].[O:66]1[CH2:67][CH2:68][CH2:69][CH2:70]1.[OH2:65]>>[Cl:1][c:2]1[c:3]([NH:40][C:41](=[O:42])[NH:43][CH:44]2[CH2:45][CH2:46]2)[cH:4][cH:5][c:6]([O:8][c:9]2[c:10]3[c:11]([n:12][cH:13][n:14]2)[nH:15][c:16](-[c:18]2[cH:19][cH:20][c:21]([O:24][CH2:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31])[cH:22][cH:23]2)[cH:17]3)[cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-900bab6eb22f417ab8efa26d82da88d5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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