Acetic Acid → Methyl 4-[((4-chlorobenzoyl)ethoxycarbonylmethylamino)methyl]-3-[4-(1-pyrrolidinecarbonyl)benzylamino]-benzoate
Reaction equation
[C:48]([O:49][BH-:50]([O:51][C:52](=[O:53])[CH3:54])[O:55][C:56](=[O:57])[CH3:58])(=[O:59])[CH3:60].[CH3:44][C:45](=[O:46])[OH:47].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[CH2:8][CH2:9][O:10][C:11](=[O:12])[CH2:13][NH:14][CH2:15][c:16]2[c:17]([NH2:26])[cH:18][c:19]([C:20](=[O:21])[O:22][CH3:23])[cH:24][cH:25]2)[cH:27][cH:28]1.[Cl:62][CH2:63][Cl:64].[N:29]1([C:34](=[O:35])[c:36]2[cH:37][cH:38][c:39]([CH:40]=[O:41])[cH:42][cH:43]2)[CH2:30][CH2:31][CH2:32][CH2:33]1.[Na+:61]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[CH2:8][CH2:9][O:10][C:11](=[O:12])[CH2:13][NH:14][CH2:15][c:16]2[c:17]([NH:26][CH2:40][c:39]3[cH:38][cH:37][c:36]([C:34]([N:29]4[CH2:30][CH2:31][CH2:32][CH2:33]4)=[O:35])[cH:43][cH:42]3)[cH:18][c:19]([C:20](=[O:21])[O:22][CH3:23])[cH:24][cH:25]2)[cH:27][cH:28]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-72cc2c20347644d89ad8f8954596feaa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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