Vitas-M small molecule compound
(1S,9aR)-1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-5-methyloctahydro-2H-quinolizinium
Catalog ID
STL552873
SMILES O=C1N(C[C@@H]2CCC[N+]3([C@@H]2CCCC3)C)C(=O)c2c1cccc2
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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 C19H25N2O2 MW 313.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N2O2/c1-21-11-5-4-10-17(21)14(7-6-12-21)13-20-18(22)15-8-2-3-9-16(15)19(20)23/h2-3,8-9,14,17H,4-7,10-13H2,1H3/q+1/t14-,17+,21?/m0/s1InChIKey
UMWVQFMDELFMHV-FYNSKXJZSA-NSynonyms
(1S9aR)1((13dioxo13dihydro2Hisoindol2yl)methyl)5methyloctahydro2Hquinolizinium
(1S9aR)1((13dioxoisoindolin2yl)methyl)5methyldecahydroquinolizin5iumiodide
2(((1~(S)9~(a)~(R))5methyl23467899~(a)octahydro1~(H)quinolizin5ium1yl)methyl)isoindole13dione
6941984
InChI=1SC19H25N2O2c12111541017(21)14(761221)132018(22)15823916(15)19(20)23h23891417H471013H21H3q+1t1417+21?m0s1
O=C1N(C(C@@H)2CCC(N+)3((C@@H)2CCCC3)C)C(=O)c2c1cccc2(I)
ZINC000248088504
ZINC000252441416
ZINC1063797
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