Vitas-M small molecule compound
2-{2-ethoxy-4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenoxy}-1-(piperidin-1-yl)ethanone
Catalog ID
STK258627
SMILES CCOc1cc(ccc1OCC(=O)N1CCCCC1)/C=C/c1onc(c1[N+](=O)[O-])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 C21H25N3O6 MW 415.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O6/c1-3-28-19-13-16(8-10-18-21(24(26)27)15(2)22-30-18)7-9-17(19)29-14-20(25)23-11-5-4-6-12-23/h7-10,13H,3-6,11-12,14H2,1-2H3/b10-8+InChIKey
RJZODDNBQVDMQZ-CSKARUKUSA-NSynonyms
2(2ethoxy4((E)2(3methyl4nitro12oxazol5yl)ethenyl)phenoxy)1(piperidin1yl)ethanone
2(2ethoxy4((E)2(3methyl4nitro12oxazol5yl)ethenyl)phenoxy)1piperidin1ylethanone
CCOC1=C(C=CC(=C1)C=CC2=C(C(=NO2)C)(N+)(=O)(O))OCC(=O)N3CCCCC3
CCOc1cc(ccc1OCC(=O)N1CCCCC1)C=Cc1onc(c1(N+)(=O)(O))C
InChI=1SC21H25N3O6c1328191316(8101821(24(26)27)15(2)223018)7917(19)291420(25)23115461223h71013H36111214H212H3b108+
MFCD03270820
ZINC000009295459
ZINC09295459
ZINC9295459
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