Vitas-M small molecule compound
(2Z)-2-(2,5-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-chlorobutanoate
Catalog ID
STK852874
SMILES ClCCCC(=O)Oc1ccc2c(c1)O/C(=C\c1cc(OC)ccc1OC)/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 C21H19ClO6 MW 402.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClO6/c1-25-14-6-8-17(26-2)13(10-14)11-19-21(24)16-7-5-15(12-18(16)28-19)27-20(23)4-3-9-22/h5-8,10-12H,3-4,9H2,1-2H3/b19-11-InChIKey
ZGDTUKBZZLUEMI-ODLFYWEKSA-NSynonyms
899408-89-0((2Z)2((25DIMETHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)4CHLOROBUTANOATE
(2Z)2(25dimethoxybenzylidene)3oxo23dihydro1benzofuran6yl4chlorobutanoate
(Z)2(25DIMETHOXYBENZYLIDENE)3OXO23DIHYDROBENZOFURAN6YL4CHLOROBUTANOATE
2((25DIMETHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL4CHLOROBUTANOATE
899408890
ClCCCC(=O)Oc1ccc2c(c1)OC(=Cc1cc(OC)ccc1OC)C2=O
COC1=CC(=C(C=C1)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)CCCCl
InChI=1SC21H19ClO6c125146817(262)13(1014)111921(24)167515(1218(16)2819)2720(23)43922h581012H349H212H3b1911
MFCD06609159
ZINC000013540830
ZINC13540830
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