Vitas-M small molecule compound
(4Z)-4-[2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STL257903
SMILES O=C1OC(=N/C/1=C\1/C=C(Oc2c1cccc2)c1ccc2c(c1)OCO2)c1ccc(cc1)[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 C25H14N2O7 MW 454.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H14N2O7/c28-25-23(26-24(34-25)14-5-8-16(9-6-14)27(29)30)18-12-21(33-19-4-2-1-3-17(18)19)15-7-10-20-22(11-15)32-13-31-20/h1-12H,13H2/b23-18-InChIKey
WRMFHEPAIRFIMN-NKFKGCMQSA-NSynonyms
1795143-83-7(4Z)4(2(13benzodioxol5yl)4Hchromen4ylidene)2(4nitrophenyl)13oxazol5(4H)one
(4Z)4(2(13benzodioxol5yl)chromen4ylidene)2(4nitrophenyl)13oxazol5one
1795143837
C1OC2=C(O1)C=C(C=C2)C3=CC(=C4C(=O)OC(=N4)C5=CC=C(C=C5)(N+)(=O)(O))C6=CC=CC=C6O3
InChI=1SC25H14N2O7c282523(2624(3425)145816(9614)27(29)30)181221(3319421317(18)19)157102022(1115)32133120h112H13H2b2318
MFCD24851064
O=C1OC(=NC1=C1C=C(Oc2c1cccc2)c1ccc2c(c1)OCO2)c1ccc(cc1)(N+)(=O)(O)
ZINC000080340527
ZINC80340527
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