Vitas-M small molecule compound
(4Z)-2-(2-chloro-4-nitrophenyl)-4-(3-methoxy-4-propoxybenzylidene)-1,3-oxazol-5(4H)-one
Catalog ID
STK536158
SMILES CCCOc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1ccc(cc1Cl)[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 C20H17ClN2O6 MW 416.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O6/c1-3-8-28-17-7-4-12(10-18(17)27-2)9-16-20(24)29-19(22-16)14-6-5-13(23(25)26)11-15(14)21/h4-7,9-11H,3,8H2,1-2H3/b16-9-InChIKey
CMQUZQUVDNGHKK-SXGWCWSVSA-NSynonyms
(4Z)2(2CHLORO4NITROPHENYL)4((3METHOXY4PROPOXYPHENYL)METHYLIDENE)13OXAZOL5ONE
(4Z)2(2chloro4nitrophenyl)4(3methoxy4propoxybenzylidene)13oxazol5(4H)one
(Z)2(2chloro4nitrophenyl)4(3methoxy4propoxybenzylidene)oxazol5(4H)one
CCCOC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=C(C=C(C=C3)(N+)(=O)(O))Cl)OC
CCCOc1ccc(cc1OC)C=C1N=C(OC1=O)c1ccc(cc1Cl)(N+)(=O)(O)
InChI=1SC20H17ClN2O6c13828177412(1018(17)272)91620(24)2919(2216)146513(23(25)26)1115(14)21h47911H38H212H3b169
MFCD01118205
ZINC000001813824
ZINC01813824
ZINC1813824
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