Vitas-M small molecule compound
4-methoxybenzyl 2-methyl-5-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK058696
SMILES COc1ccc(cc1)COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)C(F)(F)F)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 C26H24F3NO4 MW 471.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24F3NO4/c1-15-22(25(32)34-14-16-6-12-19(33-2)13-7-16)23(24-20(30-15)4-3-5-21(24)31)17-8-10-18(11-9-17)26(27,28)29/h6-13,23,30H,3-5,14H2,1-2H3InChIKey
DGTLLJMBCCEMKY-UHFFFAOYSA-NSynonyms
(4methoxyphenyl)methyl2methyl5oxo4(4(trifluoromethyl)phenyl)4678tetrahydro1Hquinoline3carboxylate
4methoxybenzyl2methyl5oxo4(4(trifluoromethyl)phenyl)145678hexahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)C(F)(F)F)C(=O)OCC4=CC=C(C=C4)OC
COc1ccc(cc1)COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)C(F)(F)F)C(=O)CCC2
InChI=1SC26H24F3NO4c11522(25(32)34141661219(332)13716)23(2420(3015)43521(24)31)1781018(11917)26(2728)29h6132330H3514H212H3
MFCD02188044
STK058696
ZINC000000969320
ZINC000000969321
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