Vitas-M small molecule compound
methyl (2Z)-3-oxo-2-[2-(prop-2-en-1-yloxy)benzylidene]-2,3-dihydro-1-benzofuran-5-carboxylate
Catalog ID
STK516327
SMILES C=CCOc1ccccc1/C=C/1\Oc2c(C1=O)cc(cc2)C(=O)OC
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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 C20H16O5 MW 336.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16O5/c1-3-10-24-16-7-5-4-6-13(16)12-18-19(21)15-11-14(20(22)23-2)8-9-17(15)25-18/h3-9,11-12H,1,10H2,2H3/b18-12-InChIKey
PJIYPZANBUOHKJ-PDGQHHTCSA-NSynonyms
C=CCOc1ccccc1C=C1Oc2c(C1=O)cc(cc2)C(=O)OC
COC(=O)C1=CC2=C(C=C1)OC(=CC3=CC=CC=C3OCC=C)C2=O
InChI=1SC20H16O5c13102416754613(16)121819(21)151114(20(22)232)8917(15)2518h391112H110H22H3b1812
methyl(2Z)3oxo2((2prop2enoxyphenyl)methylidene)1benzofuran5carboxylate
methyl(2Z)3oxo2(2(prop2en1yloxy)benzylidene)23dihydro1benzofuran5carboxylate
METHYL3OXO2((2PROP2ENYLOXYPHENYL)METHYLENE)BENZO(B)FURAN5CARBOXYLATE
MFCD06645625
ZINC000005047898
ZINC05047898
ZINC5047898
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