HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Reaction

Acetic Acid → methyl 14-cyclohexyl-7-(4-methylpiperazin-1-yl)-7,8-dihydro-6H-indolo[1,2-e][1,5]benzoxazocine-11-carboxylate

HRID 307208
Notes
Print preview

Reaction equation

HRID 307208 reaction equation
[C:42]([O:43][BH-:44]([O:45][C:46](=[O:47])[CH3:48])[O:49][C:50](=[O:51])[CH3:52])(=[O:53])[CH3:54].[CH3:31][N:32]1[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]1.[CH3:38][C:39](=[O:40])[OH:41].[CH3:61][CH2:62][O:63][C:64]([CH3:65])=[O:66].[CH:1]1([c:7]2[c:8]3[cH:9][cH:10][c:11]([C:27](=[O:28])[O:29][CH3:30])[cH:12][c:13]3[n:14]3[c:21]2-[c:20]2[c:19]([cH:25][cH:24][cH:23][cH:22]2)[O:18][CH2:17][C:16](=[O:26])[CH2:15]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cl:58][CH2:59][Cl:60].[Na+:55].[Na+:57].[OH-:56]>>[CH:1]1([c:7]2[c:8]3[cH:9][cH:10][c:11]([C:27](=[O:28])[O:29][CH3:30])[cH:12][c:13]3[n:14]3[c:21]2-[c:20]2[c:19]([cH:25][cH:24][cH:23][cH:22]2)[O:18][CH2:17][CH:16]([N:35]2[CH2:34][CH2:33][N:32]([CH3:31])[CH2:37][CH2:36]2)[CH2:15]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1
ParticipantsSources & evidenceReaction notes

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 923Sodium Ion2×HCID 961HydroxideHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 531671-MethylpiperazineHCID 2724942Triacetoxyborohydride
HCID 50994368
methyl 14-cyclohexyl-7-oxo-7,8-dihydro-6H-indolo[1,2-e][1,5]benzoxazocine-11-carboxylate

Product 1

HCID 68505443methyl 14-cyclohexyl-7-(4-methylpiperazin-1-yl)-7,8-dihydro-6H-indolo[1,2-e][1,5]benzoxazocine-11-carboxylate

Sources & evidence

ORD record
ord-be5b25c617f248928074d518150de0d4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

Reaction notes

Loading…

On this pageParticipantsSources & evidenceReaction notes