Vitas-M small molecule compound
(2Z)-2-[4-(methoxycarbonyl)benzylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3-methoxybenzoate
Catalog ID
STK923757
SMILES COc1cccc(c1)C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(=O)OC)/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 C25H18O7 MW 430.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18O7/c1-29-18-5-3-4-17(13-18)25(28)31-19-10-11-20-21(14-19)32-22(23(20)26)12-15-6-8-16(9-7-15)24(27)30-2/h3-14H,1-2H3/b22-12-InChIKey
JNKXQPOBUSXYSG-UUYOSTAYSA-NSynonyms
858769-94-5((2Z)2((4METHOXYCARBONYLPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)3METHOXYBENZOATE
(2Z)2(4(methoxycarbonyl)benzylidene)3oxo23dihydro1benzofuran6yl3methoxybenzoate
(Z)2(4(methoxycarbonyl)benzylidene)3oxo23dihydrobenzofuran6yl3methoxybenzoate
2((4(METHOXYCARBONYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL3METHOXYBENZOATE
858769945
COC1=CC=CC(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(C=C4)C(=O)OC)O3
COc1cccc(c1)C(=O)Oc1ccc2c(c1)OC(=Cc1ccc(cc1)C(=O)OC)C2=O
InChI=1SC25H18O7c1291853417(1318)25(28)311910112021(1419)3222(23(20)26)12156816(9715)24(27)302h314H12H3b2212
MFCD04145913
ZINC000011868879
ZINC11868879
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