Vitas-M small molecule compound

ethyl {4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenoxy}acetate

Catalog ID
STL376630
SMILES CCOC(=O)COc1ccc(cc1)/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 C16H16N2O6 MW 332.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O6/c1-3-22-15(19)10-23-13-7-4-12(5-8-13)6-9-14-16(18(20)21)11(2)17-24-14/h4-9H,3,10H2,1-2H3/b9-6+
InChIKey
POQXQHFBKTZJBY-RMKNXTFCSA-N
Synonyms

CCOC(=O)COC1=CC=C(C=C1)C=CC2=C(C(=NO2)C)(N+)(=O)(O)
CCOC(=O)COc1ccc(cc1)C=Cc1onc(c1(N+)(=O)(O))C
ethyl(4((E)2(3methyl4nitro12oxazol5yl)ethenyl)phenoxy)acetate
ETHYL2(4((E)2(3METHYL4NITRO12OXAZOL5YL)ETHENYL)PHENOXY)ACETATE
InChI=1SC16H16N2O6c132215(19)1023137412(5813)691416(18(20)21)11(2)172414h49H310H212H3b96+
MFCD06753172
ZINC000004511279
ZINC04511279
ZINC4511279

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.