Vitas-M small molecule compound
methyl 4-(2,5-difluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK053568
SMILES COC(=O)C1=C(C)NC2=C(C1c1cc(F)ccc1F)C(=O)CCC2
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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 C18H17F2NO3 MW 333.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17F2NO3/c1-9-15(18(23)24-2)16(11-8-10(19)6-7-12(11)20)17-13(21-9)4-3-5-14(17)22/h6-8,16,21H,3-5H2,1-2H3InChIKey
BEXDEWNYZFMRFL-UHFFFAOYSA-NSynonyms
347316-35-2347316352
CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C=CC(=C3)F)F)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1cc(F)ccc1F)C(=O)CCC2
InChI=1SC18H17F2NO3c1915(18(23)242)16(11810(19)6712(11)20)1713(219)43514(17)22h681621H35H212H3
methyl4(25difluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(25difluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD02188070
STK053568
ZINC000019810979
ZINC000019810983
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