Vitas-M small molecule compound

ethyl 3-{6-chloro-7-[(3,4-dichlorobenzyl)oxy]-4-methyl-2-oxo-2H-chromen-3-yl}propanoate

Catalog ID
STK716772
SMILES CCOC(=O)CCc1c(=O)oc2c(c1C)cc(c(c2)OCc1ccc(c(c1)Cl)Cl)Cl

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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 C22H19Cl3O5 MW 469.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19Cl3O5/c1-3-28-21(26)7-5-14-12(2)15-9-18(25)20(10-19(15)30-22(14)27)29-11-13-4-6-16(23)17(24)8-13/h4,6,8-10H,3,5,7,11H2,1-2H3
InChIKey
NJMZGYDNNVULLN-UHFFFAOYSA-N
Synonyms
840515-08-4
840515084
CCOC(=O)CCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=CC(=C(C=C3)Cl)Cl)Cl)C
ethyl3(6chloro7((34dichlorobenzyl)oxy)4methyl2oxo2Hchromen3yl)propanoate
ETHYL3(6CHLORO7((34DICHLOROPHENYL)METHOXY)4METHYL2OXOCHROMEN3YL)PROPANOATE
InChI=1SC22H19Cl3O5c132821(26)751412(2)15918(25)20(1019(15)3022(14)27)2911134616(23)17(24)813h46810H35711H212H3
MFCD04010211
ZINC000002351642
ZINC02351642
ZINC2351642

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Available files

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