Vitas-M small molecule compound
(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-6-[(3-methylbut-2-en-1-yl)oxy]-1-benzofuran-3(2H)-one
Catalog ID
STK630904
SMILES CC(=CCOc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O)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 C22H19ClO5 MW 398.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClO5/c1-13(2)5-6-26-17-3-4-18-19(10-17)28-20(21(18)24)9-14-7-16(23)8-15-11-25-12-27-22(14)15/h3-5,7-10H,6,11-12H2,1-2H3/b20-9-InChIKey
ZHASXNHTLPFRPD-UKWGHVSLSA-NSynonyms
929511-11-5(2Z)2((6chloro4H13benzodioxin8yl)methylidene)6((3methylbut2en1yl)oxy)1benzofuran3(2H)one
(2Z)2((6chloro4H13benzodioxin8yl)methylidene)6(3methylbut2enoxy)1benzofuran3one
(Z)2((6chloro4Hbenzo(d)(13)dioxin8yl)methylene)6((3methylbut2en1yl)oxy)benzofuran3(2H)one
2((6CHLORO(2H4HBENZO(E)13DIOXIN8YL))METHYLENE)6(3METHYLBUT2ENYLOXY)BENZO(B)FURAN3ONE
929511115
CC(=CCOC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=CC4=C3OCOC4)Cl)O2)C
CC(=CCOc1ccc2c(c1)OC(=Cc1cc(Cl)cc3c1OCOC3)C2=O)C
InChI=1SC22H19ClO5c113(2)562617341819(1017)2820(21(18)24)914716(23)8151125122722(14)15h35710H61112H212H3b209
MFCD09792537
ZINC000009486738
ZINC09486738
ZINC9486738
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