Benzene → Ethyl 7-{[4-(acetyloxy)nonyl](cyano)amino}heptanoate
Reaction equation
[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[Cl:17][CH2:18][CH2:19][CH2:20][CH:21]([CH2:22][CH2:23][CH2:24][CH2:25][CH3:26])[O:27][C:28]([CH3:29])=[O:30].[H-:1].[NH:3]([C:4]#[N:5])[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][C:12](=[O:13])[O:14][CH2:15][CH3:16].[Na+:2].[OH2:31].[cH:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[N:3]([C:4]#[N:5])([CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][C:12](=[O:13])[O:14][CH2:15][CH3:16])[CH2:18][CH2:19][CH2:20][CH:21]([CH2:22][CH2:23][CH2:24][CH2:25][CH3:26])[O:27][C:28]([CH3:29])=[O:30]Participants
8
Sources & evidence
- ORD record
- ord-1c8abcfee60f49b4a4f77fa4bbc23e33
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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