Vitas-M small molecule compound

methyl 2-methyl-6-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6-tetrahydropyridine-3-carboxylate

Catalog ID
STK045849
SMILES COC(=O)C1=C(C)NC(=O)CC1c1ccccc1C(F)(F)F

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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 C15H14F3NO3 MW 313.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14F3NO3/c1-8-13(14(21)22-2)10(7-12(20)19-8)9-5-3-4-6-11(9)15(16,17)18/h3-6,10H,7H2,1-2H3,(H,19,20)
InChIKey
QTXSNNSHDVEEIR-UHFFFAOYSA-N
Synonyms

CC1=C(C(CC(=O)N1)C2=CC=CC=C2C(F)(F)F)C(=O)OC
COC(=O)C1=C(C)NC(=O)CC1c1ccccc1C(F)(F)F
InChI=1SC15H14F3NO3c1813(14(21)222)10(712(20)198)9534611(9)15(1617)18h3610H7H212H3(H1920)
methyl2methyl6oxo4(2(trifluoromethyl)phenyl)1456tetrahydropyridine3carboxylate
METHYL2METHYL6OXO4(2(TRIFLUOROMETHYL)PHENYL)145TRIHYDROPYRIDINE3CARBOXYLATE
METHYL6METHYL2OXO4(2(TRIFLUOROMETHYL)PHENYL)34DIHYDRO1HPYRIDINE5CARBOXYLATE
MFCD01193783
STK045849
ZINC000000127002
ZINC000000127006

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Available files

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