N-Hydroxysuccinimide → N-{4-[2-[bis(2-chloroethyl)amino]phenyl]butyroyl}-4-aminobutane-1,1-diphosphonic acid tetraethyl ester
Reaction equation
[CH2:28]([CH3:29])[O:30][P:31]([O:32][CH2:33][CH3:34])(=[O:35])[CH:36]([CH2:37][CH2:38][CH2:39][NH2:40])[P:41]([O:42][CH2:43][CH3:44])(=[O:45])[O:46][CH2:47][CH3:48].[Cl:1][CH2:2][CH2:3][N:4]([c:5]1[c:6]([CH2:11][CH2:12][CH2:13][C:14](=[O:15])[OH:16])[cH:7][cH:8][cH:9][cH:10]1)[CH2:17][CH2:18][Cl:19].[OH:20][N:21]1[C:22](=[O:23])[CH2:24][CH2:25][C:26]1=[O:27]>>[Cl:1][CH2:2][CH2:3][N:4]([c:5]1[c:6]([CH2:11][CH2:12][CH2:13][C:14](=[O:16])[NH:40][CH2:39][CH2:38][CH2:37][CH:36]([P:31]([O:30][CH2:28][CH3:29])([O:32][CH2:33][CH3:34])=[O:35])[P:41]([O:42][CH2:43][CH3:44])(=[O:45])[O:46][CH2:47][CH3:48])[cH:7][cH:8][cH:9][cH:10]1)[CH2:17][CH2:18][Cl:19]Participants
4
Sources & evidence
- ORD record
- ord-ff90e493aecd4338bb1012ca611b69cd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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