Vitas-M small molecule compound

ethyl 7-[2-(4-chlorophenyl)-2-oxoethoxy]-3-(2-methoxyphenyl)-4-oxo-4H-chromene-2-carboxylate

Catalog ID
STK888604
SMILES CCOC(=O)c1oc2cc(OCC(=O)c3ccc(cc3)Cl)ccc2c(=O)c1c1ccccc1OC

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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 C27H21ClO7 MW 492.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21ClO7/c1-3-33-27(31)26-24(19-6-4-5-7-22(19)32-2)25(30)20-13-12-18(14-23(20)35-26)34-15-21(29)16-8-10-17(28)11-9-16/h4-14H,3,15H2,1-2H3
InChIKey
HJHKYDOQNZMSSO-UHFFFAOYSA-N
Synonyms
610763-65-0
610763650
CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4OC
ethyl7(2(4chlorophenyl)2oxoethoxy)3(2methoxyphenyl)4oxo4Hchromene2carboxylate
ETHYL7(2(4CHLOROPHENYL)2OXOETHOXY)3(2METHOXYPHENYL)4OXOCHROMENE2CARBOXYLATE
InChI=1SC27H21ClO7c133327(31)2624(19645722(19)322)25(30)20131218(1423(20)3526)341521(29)1681017(28)11916h414H315H212H3
MFCD03696040
ZINC000001464061
ZINC01464061
ZINC1464061

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Available files

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