Vitas-M small molecule compound

methyl 4-[(Z)-{6-[2-(4-methoxyphenyl)-2-oxoethoxy]-3-oxo-1-benzofuran-2(3H)-ylidene}methyl]benzoate

Catalog ID
STK923958
SMILES COc1ccc(cc1)C(=O)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(=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 C26H20O7 MW 444.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20O7/c1-30-19-9-7-17(8-10-19)22(27)15-32-20-11-12-21-23(14-20)33-24(25(21)28)13-16-3-5-18(6-4-16)26(29)31-2/h3-14H,15H2,1-2H3/b24-13-
InChIKey
YGURREBNYMNOOA-CFRMEGHHSA-N
Synonyms
858769-85-4
(Z)methyl4((6(2(4methoxyphenyl)2oxoethoxy)3oxobenzofuran2(3H)ylidene)methyl)benzoate
858769854
COC1=CC=C(C=C1)C(=O)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(C=C4)C(=O)OC)O3
COc1ccc(cc1)C(=O)COc1ccc2c(c1)OC(=Cc1ccc(cc1)C(=O)OC)C2=O
InChI=1SC26H20O7c130199717(81019)22(27)15322011122123(1420)3324(25(21)28)13163518(6416)26(29)312h314H15H212H3b2413
METHYL4((6(2(4METHOXYPHENYL)2OXOETHOXY)3OXOBENZO(D)FURAN2YLIDENE)METHYL)BENZOATE
methyl4((Z)(6(2(4methoxyphenyl)2oxoethoxy)3oxo1benzofuran2(3H)ylidene)methyl)benzoate
METHYL4((Z)(6(2(4METHOXYPHENYL)2OXOETHOXY)3OXO1BENZOFURAN2YLIDENE)METHYL)BENZOATE
MFCD04145882
ZINC000011869195
ZINC11869195

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Available files

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