Vitas-M small molecule compound
1-{4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl}-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone
Catalog ID
STK198622
SMILES O=C(N1CCN(CC1)c1ccc(cc1C(F)(F)F)[N+](=O)[O-])CC12CC3CC(C2)CC(C1)C3
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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 C23H28F3N3O3 MW 451.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28F3N3O3/c24-23(25,26)19-10-18(29(31)32)1-2-20(19)27-3-5-28(6-4-27)21(30)14-22-11-15-7-16(12-22)9-17(8-15)13-22/h1-2,10,15-17H,3-9,11-14H2InChIKey
MAFIPOYIVXJXIL-UHFFFAOYSA-NSynonyms
1(4(4nitro2(trifluoromethyl)phenyl)piperazin1yl)2(tricyclo(3311~37~)dec1yl)ethanone
2(1ADAMANTYL)1(4(4NITRO2(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)ETHANONE
C1CN(CCN1C2=C(C=C(C=C2)(N+)(=O)(O))C(F)(F)F)C(=O)CC34CC5CC(C3)CC(C5)C4
InChI=1SC23H28F3N3O3c2423(2526)191018(29(31)32)1220(19)273528(6427)21(30)14221115716(1222)917(815)1322h12101517H391114H2
MFCD05826392
O=C(N1CCN(CC1)c1ccc(cc1C(F)(F)F)(N+)(=O)(O))CC12CC3CC(C2)CC(C1)C3
ZINC000009934600
ZINC09934600
ZINC9934600
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