Vitas-M small molecule compound

ethyl 4-[(4Z)-3-hydroxy-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoate

Catalog ID
STL509160
SMILES CCOC(=O)c1ccc(cc1)N1N=C(/C(=C/c2ccc(cc2)O)/C1=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 C19H16N2O5 MW 352.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O5/c1-2-26-19(25)13-5-7-14(8-6-13)21-18(24)16(17(23)20-21)11-12-3-9-15(22)10-4-12/h3-11,22H,2H2,1H3,(H,20,23)/b16-11-
InChIKey
NZXSGALZXYZUSH-WJDWOHSUSA-N
Synonyms

2253625
ethyl4((4~(Z))4((4hydroxyphenyl)methylidene)35dioxopyrazolidin1yl)benzoate
ethyl4((4Z)3hydroxy4(4hydroxybenzylidene)5oxo45dihydro1Hpyrazol1yl)benzoate
ETHYL4((4Z)4((4HYDROXYPHENYL)METHYLIDENE)35DIOXOPYRAZOLIDIN1YL)BENZOATE
InChI=1SC19H16N2O5c122619(25)135714(8613)2118(24)16(17(23)2021)11123915(22)10412h31122H2H21H3(H2023)b1611
MFCD31657820
ZINC000005009925
ZINC5009925

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Available files

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