Vitas-M small molecule compound
(1R,9aR)-1-[({[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}oxy)methyl]-5-methyloctahydro-2H-quinolizinium
Catalog ID
STL552833
SMILES O=C(c1c(C)onc1c1ccccc1Cl)OC[C@@H]1CCC[N+]2([C@@H]1CCCC2)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 C22H28ClN2O3 MW 403.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28ClN2O3/c1-15-20(21(24-28-15)17-9-3-4-10-18(17)23)22(26)27-14-16-8-7-13-25(2)12-6-5-11-19(16)25/h3-4,9-10,16,19H,5-8,11-14H2,1-2H3/q+1/t16-,19+,25?/m0/s1InChIKey
FPVGTJGAJPZJET-WFBICUIVSA-NSynonyms
((1~(R)9~(a)~(R))5methyl23467899~(a)octahydro1~(H)quinolizin5ium1yl)methyl3(2chlorophenyl)5methyl12oxazole4carboxylate
(1R9aR)1((((3(2chlorophenyl)5methyl12oxazol4yl)carbonyl)oxy)methyl)5methyloctahydro2Hquinolizinium
(1R9aR)1(((3(2chlorophenyl)5methylisoxazole4carbonyl)oxy)methyl)5methyldecahydroquinolizin5iumiodide
11874039
InChI=1SC22H28ClN2O3c11520(21(242815)179341018(17)23)22(26)271416871325(2)12651119(16)25h349101619H581114H212H3q+1t1619+25?m0s1
O=C(c1c(C)onc1c1ccccc1Cl)OC(C@@H)1CCC(N+)2((C@@H)1CCCC2)C(I)
ZINC000253389782
ZINC000253389783
ZINC4029086
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