Vitas-M small molecule compound
methyl 2-{[(2Z)-2-(4-ethylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}propanoate
Catalog ID
STK857204
SMILES COC(=O)C(Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)CC)/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 C21H20O5 MW 352.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O5/c1-4-14-5-7-15(8-6-14)11-19-20(22)17-10-9-16(12-18(17)26-19)25-13(2)21(23)24-3/h5-13H,4H2,1-3H3/b19-11-InChIKey
ORARZNXRUJAGFV-ODLFYWEKSA-NSynonyms
620546-38-5(Z)methyl2((2(4ethylbenzylidene)3oxo23dihydrobenzofuran6yl)oxy)propanoate
620546385
CCC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(C)C(=O)OC
COC(=O)C(Oc1ccc2c(c1)OC(=Cc1ccc(cc1)CC)C2=O)C
InChI=1SC21H20O5c14145715(8614)111920(22)1710916(1218(17)2619)2513(2)21(23)243h513H4H213H3b1911
METHYL2(((2Z)2((4ETHYLPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)PROPANOATE
methyl2(((2Z)2(4ethylbenzylidene)3oxo23dihydro1benzofuran6yl)oxy)propanoate
METHYL2(2((4ETHYLPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)PROPANOATE
MFCD04176185
ZINC000006555751
ZINC000006555752
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