Water → HCID 44243179, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:10][C:11](=[O:12])[NH:13][c:14]2[cH:15][c:16]([O:20][c:21]3[n:22][cH:23][n:24][c:25]4[cH:26][c:27]([O:35][CH3:36])[c:28]([O:31][CH2:32][CH2:33][Cl:34])[cH:29][c:30]34)[cH:17][cH:18][cH:19]2)[n:8][o:9]1.[CH2:37]1[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]1.[CH2:44]([N+:45]([CH2:46][CH2:47][CH2:48][CH3:49])([CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH2:56][CH3:57])[CH2:58][CH2:59][CH3:60].[I-:43].[OH2:61]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:10][C:11](=[O:12])[NH:13][c:14]2[cH:15][c:16]([O:20][c:21]3[n:22][cH:23][n:24][c:25]4[cH:26][c:27]([O:35][CH3:36])[c:28]([O:31][CH2:32][CH2:33][N:40]5[CH2:39][CH2:38][CH2:37][CH2:42][CH2:41]5)[cH:29][c:30]34)[cH:17][cH:18][cH:19]2)[n:8][o:9]1Participants
6
Sources & evidence
- ORD record
- ord-17e774bbe85e425ab65952767220bd29
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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