Vitas-M small molecule compound
(2Z)-2-(4-ethylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2-methylpropanoate
Catalog ID
STK623842
SMILES CCc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)C(C)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 C21H20O4 MW 336.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O4/c1-4-14-5-7-15(8-6-14)11-19-20(22)17-10-9-16(12-18(17)25-19)24-21(23)13(2)3/h5-13H,4H2,1-3H3/b19-11-InChIKey
JNXGCNILTLBNTK-ODLFYWEKSA-NSynonyms
622359-55-1((2Z)2((4ETHYLPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)2METHYLPROPANOATE
(2Z)2(4ethylbenzylidene)3oxo23dihydro1benzofuran6yl2methylpropanoate
(Z)2(4ethylbenzylidene)3oxo23dihydrobenzofuran6ylisobutyrate
2((4ETHYLPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL2METHYLPROPANOATE
622359551
CCC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C(C)C
CCc1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2)OC(=O)C(C)C
InChI=1SC21H20O4c14145715(8614)111920(22)1710916(1218(17)2519)2421(23)13(2)3h513H4H213H3b1911
MFCD04144668
ZINC000013653853
ZINC13653853
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