Vitas-M small molecule compound
(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl acetate
Catalog ID
STL033012
SMILES CC(=O)Oc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/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 C18H12O6 MW 324.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12O6/c1-10(19)23-12-3-4-13-15(8-12)24-17(18(13)20)7-11-2-5-14-16(6-11)22-9-21-14/h2-8H,9H2,1H3/b17-7-InChIKey
PYZOZKKUKGNTFZ-IDUWFGFVSA-NSynonyms
210361-36-7((2Z)2(13BENZODIOXOL5YLMETHYLIDENE)3OXO1BENZOFURAN6YL)ACETATE
(2Z)2(13benzodioxol5ylmethylidene)3oxo23dihydro1benzofuran6ylacetate
(Z)2(benzo(d)(13)dioxol5ylmethylene)3oxo23dihydrobenzofuran6ylacetate
2(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)3OXOBENZO(34B)FURAN6YLACETATE
210361367
CC(=O)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC4=C(C=C3)OCO4)O2
CC(=O)Oc1ccc2c(c1)OC(=Cc1ccc3c(c1)OCO3)C2=O
InChI=1SC18H12O6c110(19)2312341315(812)2417(18(13)20)711251416(611)2292114h28H9H21H3b177
MFCD06494066
ZINC000005825099
ZINC05825099
ZINC5825099
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