Vitas-M small molecule compound
ethyl 2,7,7-trimethyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK019577
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccccc1C(F)(F)F)C(=O)CC(C2)(C)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 C22H24F3NO3 MW 407.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24F3NO3/c1-5-29-20(28)17-12(2)26-15-10-21(3,4)11-16(27)19(15)18(17)13-8-6-7-9-14(13)22(23,24)25/h6-9,18,26H,5,10-11H2,1-4H3InChIKey
ADRLFQYAAGFRPK-UHFFFAOYSA-NSynonyms
78050-80-378050803
CCOC(=O)C1=C(C)NC2=C(C1c1ccccc1C(F)(F)F)C(=O)CC(C2)(C)C
CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3C(F)(F)F)C(=O)CC(C2)(C)C)C
ethyl277trimethyl5oxo4(2(trifluoromethyl)phenyl)145678hexahydroquinoline3carboxylate
ethyl277trimethyl5oxo4(2(trifluoromethyl)phenyl)1468tetrahydroquinoline3carboxylate
InChI=1SC22H24F3NO3c152920(28)1712(2)26151021(34)1116(27)19(15)18(17)13867914(13)22(2324)25h691826H51011H214H3
MFCD00345039
STK019577
ZINC000019314519
ZINC000019314522
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