(+/-)-6-[Acetyl-(3,5-bis-trifluoromethyl-benzyl)-amino]-4-methyl-2,3,6,7,8,9-hexahydro-1H-10-aza-cyclohepta[e]indene-10-carboxylic acid isopropyl ester → (+/-)-9-[Acetyl-(3,5-bis-trifluoromethyl-benzyl)-amino]-4-methyl-2,3,6,7,8,9-hexahydro-1H-5-aza-cyclohepta[f]indene-5-carboxylic acid isopropyl ester
Reaction equation
[CH3:41][O:42][C:43]([c:44]1[cH:45][c:46]2[c:47]([cH:48][c:49]1[NH2:50])[CH2:51][CH2:52][CH2:53]2)=[O:54].[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH2:10][CH:11]([N:22]([CH2:23][c:24]2[cH:25][c:26]([C:34]([F:35])([F:36])[F:37])[cH:27][c:28]([C:30]([F:31])([F:32])[F:33])[cH:29]2)[C:38]([CH3:39])=[O:40])[c:12]2[c:13]1[c:14]1[c:18]([c:19]([CH3:21])[cH:20]2)[CH2:17][CH2:16][CH2:15]1>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH2:10][CH:11]([N:22]([CH2:23][c:24]2[cH:25][c:26]([C:34]([F:35])([F:36])[F:37])[cH:27][c:28]([C:30]([F:31])([F:32])[F:33])[cH:29]2)[C:38]([CH3:39])=[O:40])[c:12]2[c:13]1[c:14]([CH3:15])[c:18]1[c:19]([cH:20]2)[CH2:21][CH2:16][CH2:17]1Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-aabaef897a60412fa256ab8d4fa6632c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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