Vitas-M small molecule compound

methyl {[(2Z)-2-(4-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate

Catalog ID
STK852375
SMILES COC(=O)COc1ccc2c(c1C)O/C(=C\c1ccc(cc1)OC)/C2=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 C20H18O6 MW 354.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18O6/c1-12-16(25-11-18(21)24-3)9-8-15-19(22)17(26-20(12)15)10-13-4-6-14(23-2)7-5-13/h4-10H,11H2,1-3H3/b17-10-
InChIKey
VJUJJIHHTUPUFZ-YVLHZVERSA-N
Synonyms
896813-73-3
(Z)methyl2((2(4methoxybenzylidene)7methyl3oxo23dihydrobenzofuran6yl)oxy)acetate
896813733
CC1=C(C=CC2=C1OC(=CC3=CC=C(C=C3)OC)C2=O)OCC(=O)OC
COC(=O)COc1ccc2c(c1C)OC(=Cc1ccc(cc1)OC)C2=O
InChI=1SC20H18O6c11216(251118(21)243)981519(22)17(2620(12)15)10134614(232)7513h410H11H213H3b1710
methyl(((2Z)2(4methoxybenzylidene)7methyl3oxo23dihydro1benzofuran6yl)oxy)acetate
METHYL2(((2Z)2((4METHOXYPHENYL)METHYLIDENE)7METHYL3OXO1BENZOFURAN6YL)OXY)ACETATE
METHYL2(2((4METHOXYPHENYL)METHYLENE)7METHYL3OXOBENZO(34B)FURAN6YLOXY)ACETATE
MFCD06596577
ZINC000005342428
ZINC05342428
ZINC5342428

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Available files

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