Vitas-M small molecule compound
cyclooctyl 2-methyl-6-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6-tetrahydropyridine-3-carboxylate
Catalog ID
STK406717
SMILES O=C1NC(=C(C(C1)c1ccccc1C(F)(F)F)C(=O)OC1CCCCCCC1)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 C22H26F3NO3 MW 409.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26F3NO3/c1-14-20(21(28)29-15-9-5-3-2-4-6-10-15)17(13-19(27)26-14)16-11-7-8-12-18(16)22(23,24)25/h7-8,11-12,15,17H,2-6,9-10,13H2,1H3,(H,26,27)InChIKey
HEIHDXPRKBFQQQ-UHFFFAOYSA-NSynonyms
CC1=C(C(CC(=O)N1)C2=CC=CC=C2C(F)(F)F)C(=O)OC3CCCCCCC3
cyclooctyl2methyl6oxo4(2(trifluoromethyl)phenyl)1456tetrahydropyridine3carboxylate
CYCLOOCTYL2METHYL6OXO4(2(TRIFLUOROMETHYL)PHENYL)145TRIHYDROPYRIDINE3CARBOXYLATE
CYCLOOCTYL6METHYL2OXO4(2(TRIFLUOROMETHYL)PHENYL)34DIHYDRO1HPYRIDINE5CARBOXYLATE
InChI=1SC22H26F3NO3c11420(21(28)29159532461015)17(1319(27)2614)1611781218(16)22(2324)25h7811121517H2691013H21H3(H2627)
MFCD07613306
ZINC000004916708
ZINC000004916715
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