Vitas-M small molecule compound

methyl {4-[(Z)-(6-ethoxy-3-oxo-1-benzofuran-2(3H)-ylidene)methyl]-2-methoxyphenoxy}acetate

Catalog ID
STK992059
SMILES CCOc1ccc2c(c1)O/C(=C\c1ccc(c(c1)OC)OCC(=O)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 C21H20O7 MW 384.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O7/c1-4-26-14-6-7-15-17(11-14)28-19(21(15)23)10-13-5-8-16(18(9-13)24-2)27-12-20(22)25-3/h5-11H,4,12H2,1-3H3/b19-10-
InChIKey
IFNOWHXIDZLSOM-GRSHGNNSSA-N
Synonyms
893380-81-9
(Z)methyl2(4((6ethoxy3oxobenzofuran2(3H)ylidene)methyl)2methoxyphenoxy)acetate
893380819
CCOC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)OC)OC)O2
CCOc1ccc2c(c1)OC(=Cc1ccc(c(c1)OC)OCC(=O)OC)C2=O
InChI=1SC21H20O7c142614671517(1114)2819(21(15)23)10135816(18(913)242)271220(22)253h511H412H213H3b1910
methyl(4((Z)(6ethoxy3oxo1benzofuran2(3H)ylidene)methyl)2methoxyphenoxy)acetate
METHYL2(4((6ETHOXY3OXOBENZO(D)FURAN2YLIDENE)METHYL)2METHOXYPHENOXY)ACETATE
METHYL2(4((Z)(6ETHOXY3OXO1BENZOFURAN2YLIDENE)METHYL)2METHOXYPHENOXY)ACETATE
MFCD06745625
ZINC000004478681
ZINC04478681
ZINC4478681

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Available files

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