Vitas-M small molecule compound

3-(2-methoxyethyl) 6-methyl 4-(2-fluorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

Catalog ID
STK404502
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1F)C(=O)C(C(C2)C)C(=O)OC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C23H26FNO6 MW 431.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26FNO6/c1-12-11-16-20(21(26)17(12)22(27)30-4)19(14-7-5-6-8-15(14)24)18(13(2)25-16)23(28)31-10-9-29-3/h5-8,12,17,19,25H,9-11H2,1-4H3
InChIKey
LBNHQZSYZAQARQ-UHFFFAOYSA-N
Synonyms

3(2methoxyethyl)6methyl4(2fluorophenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3O(2methoxyethyl)6Omethyl4(2fluorophenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CC1CC2=C(C(C(=C(N2)C)C(=O)OCCOC)C3=CC=CC=C3F)C(=O)C1C(=O)OC
InChI=1SC23H26FNO6c112111620(21(26)17(12)22(27)304)19(14756815(14)24)18(13(2)2516)23(28)31109293h5812171925H911H214H3
MFCD04226254
ZINC000004787838
ZINC000004787867

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.