Vitas-M small molecule compound
ethyl 4-[4-fluoro-5-(2-methylpiperidin-1-yl)-2-nitrophenyl]piperazine-1-carboxylate
Catalog ID
STK783882
SMILES CCOC(=O)N1CCN(CC1)c1cc(c(cc1[N+](=O)[O-])F)N1CCCCC1C
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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 C19H27FN4O4 MW 394.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27FN4O4/c1-3-28-19(25)22-10-8-21(9-11-22)17-13-16(15(20)12-18(17)24(26)27)23-7-5-4-6-14(23)2/h12-14H,3-11H2,1-2H3InChIKey
RALWBYSJSZFQOD-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCN(CC1)c1cc(c(cc1(N+)(=O)(O))F)N1CCCCC1C
CCOC(=O)N1CCN(CC1)C2=CC(=C(C=C2(N+)(=O)(O))F)N3CCCCC3C
ethyl4(4fluoro5(2methylpiperidin1yl)2nitrophenyl)piperazine1carboxylate
InChI=1SC19H27FN4O4c132819(25)2210821(91122)171316(15(20)1218(17)24(26)27)23754614(23)2h1214H311H212H3
MFCD06619125
ZINC000004708588
ZINC000004708590
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