Vitas-M small molecule compound

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

Catalog ID
STK992825
SMILES COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)OC(C)(C)C

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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 C23H22O7 MW 410.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22O7/c1-23(2,3)30-20(24)13-28-16-9-10-17-18(12-16)29-19(21(17)25)11-14-5-7-15(8-6-14)22(26)27-4/h5-12H,13H2,1-4H3/b19-11-
InChIKey
CRQOVJSTVAQTFI-ODLFYWEKSA-N
Synonyms
623117-74-8
(Z)methyl4((6(2(tertbutoxy)2oxoethoxy)3oxobenzofuran2(3H)ylidene)methyl)benzoate
623117748
CC(C)(C)OC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC=C(C=C3)C(=O)OC)O2
COC(=O)c1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2)OCC(=O)OC(C)(C)C
InChI=1SC23H22O7c123(23)3020(24)1328169101718(1216)2919(21(17)25)11145715(8614)22(26)274h512H13H214H3b1911
METHYL4((Z)(6(2((2METHYLPROPAN2YL)OXY)2OXOETHOXY)3OXO1BENZOFURAN2YLIDENE)METHYL)BENZOATE
methyl4((Z)(6(2tertbutoxy2oxoethoxy)3oxo1benzofuran2(3H)ylidene)methyl)benzoate
MFCD06295431
TERTBUTYL2(2((4(METHOXYCARBONYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)ACETATE
ZINC000009486624
ZINC09486624
ZINC9486624

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Available files

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