Chloride → Dimethyl 13-cyclohexyl-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-6,10-dicarboxylate

HRID 959181Notes

Reaction equation

HRID 959181 reaction equation
[CH2:9]([N+:10]([CH2:11][CH3:12])([CH2:13][CH3:14])[CH2:15][CH2:16][CH2:17][CH3:18])[CH3:19].[CH3:52][C:53]#[N:54].[CH:26]1([c:32]2[c:33](-[c:45]3[c:46]([OH:51])[cH:47][cH:48][cH:49][cH:50]3)[nH:34][c:35]3[cH:36][c:37]([C:41](=[O:42])[O:43][CH3:44])[cH:38][cH:39][c:40]23)[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]1.[Cl-:8].[Cl:1][C:2]([C:3](=[O:4])[O:5][CH3:6])=[CH2:7].[K+:20].[K+:21].[O-:22][C:23]([O-:24])=[O:25]>>[CH:2]1([C:3](=[O:4])[O:5][CH3:6])[CH2:7][n:34]2[c:33]([c:32]([CH:26]3[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]3)[c:40]3[c:35]2[cH:36][c:37]([C:41](=[O:42])[O:43][CH3:44])[cH:38][cH:39]3)-[c:45]2[c:46]([cH:47][cH:48][cH:49][cH:50]2)[O:51]1

Participants

8

Reactant 7

HCID 312ChlorideHCID 813Potassium Cation2×HCID 6342AcetonitrileHCID 6659Methyl 2-chloroacrylateHCID 19660Carbonate IonHCID 457191-Butanaminium, N,N,N-triethyl-HCID 11995228Methyl 3-cyclohexyl-2-(2-hydroxyphenyl)-1H-indole-6-carboxylate

Product 1

HCID 66674678Dimethyl 13-cyclohexyl-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-6,10-dicarboxylate

Sources & evidence

ORD record
ord-ed65c72032cb4c1389e8093205fc3bf0
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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