Vitas-M small molecule compound
2-methylpropyl 4-(3,4-difluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK011458
SMILES CC(COC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)F)F)C(=O)CCC2)C
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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 C21H23F2NO3 MW 375.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23F2NO3/c1-11(2)10-27-21(26)18-12(3)24-16-5-4-6-17(25)20(16)19(18)13-7-8-14(22)15(23)9-13/h7-9,11,19,24H,4-6,10H2,1-3H3InChIKey
KYKSDGPJNNCXRH-UHFFFAOYSA-NSynonyms
347312-64-52methylpropyl4(34difluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2methylpropyl4(34difluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
347312645
CC(COC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)F)F)C(=O)CCC2)C
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)F)F)C(=O)OCC(C)C
InChI=1SC21H23F2NO3c111(2)102721(26)1812(3)241654617(25)20(16)19(18)137814(22)15(23)913h79111924H4610H213H3
MFCD02188001
STK011458
ZINC000019775018
ZINC000019775020
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