Vitas-M small molecule compound

ethyl 2-{[(2Z)-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}propanoate

Catalog ID
STK923355
SMILES CCOC(=O)C(Oc1ccc2c(c1)O/C(=C\c1cccc(c1)[N+](=O)[O-])/C2=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 C20H17NO7 MW 383.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO7/c1-3-26-20(23)12(2)27-15-7-8-16-17(11-15)28-18(19(16)22)10-13-5-4-6-14(9-13)21(24)25/h4-12H,3H2,1-2H3/b18-10-
InChIKey
PMRNDFHFXOBYJK-ZDLGFXPLSA-N
Synonyms
672944-53-5
(Z)ethyl2((2(3nitrobenzylidene)3oxo23dihydrobenzofuran6yl)oxy)propanoate
672944535
CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=CC=C3)(N+)(=O)(O))O2
CCOC(=O)C(Oc1ccc2c(c1)OC(=Cc1cccc(c1)(N+)(=O)(O))C2=O)C
ETHYL2(((2Z)2((3NITROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)PROPANOATE
ethyl2(((2Z)2(3nitrobenzylidene)3oxo23dihydro1benzofuran6yl)oxy)propanoate
ETHYL2(2((3NITROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)PROPANOATE
InChI=1SC20H17NO7c132620(23)12(2)2715781617(1115)2818(19(16)22)101354614(913)21(24)25h412H3H212H3b1810
MFCD04078774
ZINC000005177293
ZINC000005177296

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Available files

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