Vitas-M small molecule compound
(4E)-4-{2-[2-(3-methoxyphenoxy)ethoxy]-5-nitrobenzylidene}-2-phenyl-1,3-oxazol-5(4H)-one
Catalog ID
STK088901
SMILES COc1cccc(c1)OCCOc1ccc(cc1/C=C\1/N=C(OC1=O)c1ccccc1)[N+](=O)[O-]
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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 C25H20N2O7 MW 460.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O7/c1-31-20-8-5-9-21(16-20)32-12-13-33-23-11-10-19(27(29)30)14-18(23)15-22-25(28)34-24(26-22)17-6-3-2-4-7-17/h2-11,14-16H,12-13H2,1H3/b22-15+InChIKey
VOQHISXAXNDXNU-PXLXIMEGSA-NSynonyms
(4E)4((2(2(3METHOXYPHENOXY)ETHOXY)5NITROPHENYL)METHYLIDENE)2PHENYL13OXAZOL5ONE
(4E)4(2(2(3METHOXYPHENOXY)ETHOXY)5NITROBENZYLIDENE)2PHENYL13OXAZOL5(4H)ONE
COC1=CC(=CC=C1)OCCOC2=C(C=C(C=C2)(N+)(=O)(O))C=C3C(=O)OC(=N3)C4=CC=CC=C4
COc1cccc(c1)OCCOc1ccc(cc1C=C1N=C(OC1=O)c1ccccc1)(N+)(=O)(O)
InChI=1SC25H20N2O7c1312085921(1620)3212133323111019(27(29)30)1418(23)152225(28)3424(2622)176324717h2111416H1213H21H3b2215+
MFCD03227988
STK088901
ZINC000002994696
ZINC02994696
ZINC2994696
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