Vitas-M small molecule compound
tert-butyl {[(2Z)-2-(3,4-dichlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate
Catalog ID
STK992432
SMILES O=C(OC(C)(C)C)COc1ccc2c(c1)O/C(=C\c1ccc(c(c1)Cl)Cl)/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 C21H18Cl2O5 MW 421.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2O5/c1-21(2,3)28-19(24)11-26-13-5-6-14-17(10-13)27-18(20(14)25)9-12-4-7-15(22)16(23)8-12/h4-10H,11H2,1-3H3/b18-9-InChIKey
DCJTZMAEAGUEHZ-NVMNQCDNSA-NSynonyms
620548-09-6(Z)tertbutyl2((2(34dichlorobenzylidene)3oxo23dihydrobenzofuran6yl)oxy)acetate
620548096
CC(C)(C)OC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=C(C=C3)Cl)Cl)O2
InChI=1SC21H18Cl2O5c121(23)2819(24)112613561417(1013)2718(20(14)25)9124715(22)16(23)812h410H11H213H3b189
MFCD04177893
O=C(OC(C)(C)C)COc1ccc2c(c1)OC(=Cc1ccc(c(c1)Cl)Cl)C2=O
tertbutyl(((2Z)2(34dichlorobenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetate
TERTBUTYL2(((2Z)2((34DICHLOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)ACETATE
TERTBUTYL2(2((34DICHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)ACETATE
ZINC000013655681
ZINC13655681
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