Vitas-M small molecule compound

ethyl 7-(cyanomethoxy)-3-(4-methoxyphenyl)-4-oxo-4H-chromene-2-carboxylate

Catalog ID
STK856746
SMILES CCOC(=O)c1oc2cc(OCC#N)ccc2c(=O)c1c1ccc(cc1)OC

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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 C21H17NO6 MW 379.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO6/c1-3-26-21(24)20-18(13-4-6-14(25-2)7-5-13)19(23)16-9-8-15(27-11-10-22)12-17(16)28-20/h4-9,12H,3,11H2,1-2H3
InChIKey
SWFIVEGRMLZALI-UHFFFAOYSA-N
Synonyms
610764-20-0
610764200
CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OCC#N)C3=CC=C(C=C3)OC
ethyl7(cyanomethoxy)3(4methoxyphenyl)4oxo4Hchromene2carboxylate
ETHYL7(CYANOMETHOXY)3(4METHOXYPHENYL)4OXOCHROMENE2CARBOXYLATE
InChI=1SC21H17NO6c132621(24)2018(134614(252)7513)19(23)169815(27111022)1217(16)2820h4912H311H212H3
MFCD03696036
ZINC000002216233
ZINC02216233
ZINC2216233

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Available files

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