Vitas-M small molecule compound
2-methoxyethyl 7-(4-chlorophenyl)-4-(3-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK099919
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)F)C(=O)CC(C2)c1ccc(cc1)Cl
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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 C26H25ClFNO4 MW 469.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClFNO4/c1-15-23(26(31)33-11-10-32-2)24(17-4-3-5-20(28)12-17)25-21(29-15)13-18(14-22(25)30)16-6-8-19(27)9-7-16/h3-9,12,18,24,29H,10-11,13-14H2,1-2H3InChIKey
OPXBRSOAOXODSF-UHFFFAOYSA-NSynonyms
2methoxyethyl7(4chlorophenyl)4(3fluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2methoxyethyl7(4chlorophenyl)4(3fluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)F)C(=O)OCCOC
COCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)F)C(=O)CC(C2)c1ccc(cc1)Cl
InChI=1SC26H25ClFNO4c11523(26(31)331110322)24(1743520(28)1217)2521(2915)1318(1422(25)30)166819(27)9716h3912182429H10111314H212H3
MFCD02632949
STK099919
ZINC000002731757
ZINC000002731760
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