Vitas-M small molecule compound
(3E)-3-[4-(benzyloxy)-3-chloro-5-ethoxybenzylidene]-5-phenylfuran-2(3H)-one
Catalog ID
STK521622
SMILES CCOc1cc(/C=C/2\C=C(OC2=O)c2ccccc2)cc(c1OCc1ccccc1)Cl
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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 C26H21ClO4 MW 432.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClO4/c1-2-29-24-15-19(14-22(27)25(24)30-17-18-9-5-3-6-10-18)13-21-16-23(31-26(21)28)20-11-7-4-8-12-20/h3-16H,2,17H2,1H3/b21-13+InChIKey
JAEBVGKDOLRRIK-FYJGNVAPSA-NSynonyms
(3E)3((3chloro5ethoxy4phenylmethoxyphenyl)methylidene)5phenylfuran2one
(3E)3(4(benzyloxy)3chloro5ethoxybenzylidene)5phenylfuran2(3H)one
CCOC1=C(C(=CC(=C1)C=C2C=C(OC2=O)C3=CC=CC=C3)Cl)OCC4=CC=CC=C4
CCOc1cc(C=C2C=C(OC2=O)c2ccccc2)cc(c1OCc1ccccc1)Cl
InChI=1SC26H21ClO4c1229241519(1422(27)25(24)30171895361018)13211623(3126(21)28)20117481220h316H217H21H3b2113+
MFCD03271430
ZINC000015016352
ZINC15016352
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