Vitas-M small molecule compound
tert-butyl {[(2Z)-2-(4-methylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate
Catalog ID
STK992455
SMILES O=C(OC(C)(C)C)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)C)/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 C22H22O5 MW 366.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22O5/c1-14-5-7-15(8-6-14)11-19-21(24)17-10-9-16(12-18(17)26-19)25-13-20(23)27-22(2,3)4/h5-12H,13H2,1-4H3/b19-11-InChIKey
SPMIFYPHIJUSMU-ODLFYWEKSA-NSynonyms
7048-19-3(Z)tertbutyl2((2(4methylbenzylidene)3oxo23dihydrobenzofuran6yl)oxy)acetate
7048193
CC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)OC(C)(C)C
InChI=1SC22H22O5c1145715(8614)111921(24)1710916(1218(17)2619)251320(23)2722(23)4h512H13H214H3b1911
MFCD06295421
O=C(OC(C)(C)C)COc1ccc2c(c1)OC(=Cc1ccc(cc1)C)C2=O
tertbutyl(((2Z)2(4methylbenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetate
tertbutyl2(((2Z)2((4methylphenyl)methylidene)3oxo1benzofuran6yl)oxy)acetate
TERTBUTYL2(2((4METHYLPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)ACETATE
ZINC000013655209
ZINC13655209
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