Vitas-M small molecule compound
methyl 4-{(E)-[5-(2,4-dimethylphenyl)-2-oxofuran-3(2H)-ylidene]methyl}benzoate
Catalog ID
STK064076
SMILES COC(=O)c1ccc(cc1)/C=C/1\C=C(OC1=O)c1ccc(cc1C)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 C21H18O4 MW 334.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18O4/c1-13-4-9-18(14(2)10-13)19-12-17(21(23)25-19)11-15-5-7-16(8-6-15)20(22)24-3/h4-12H,1-3H3/b17-11+InChIKey
VTLYQFXUTBBFIM-GZTJUZNOSA-NSynonyms
CC1=CC(=C(C=C1)C2=CC(=CC3=CC=C(C=C3)C(=O)OC)C(=O)O2)C
COC(=O)c1ccc(cc1)C=C1C=C(OC1=O)c1ccc(cc1C)C
InChI=1SC21H18O4c1134918(14(2)1013)191217(21(23)2519)11155716(8615)20(22)243h412H13H3b1711+
METHYL4((E)(5(24DIMETHYLPHENYL)2OXOFURAN3(2H)YLIDENE)METHYL)BENZOATE
METHYL4((E)(5(24DIMETHYLPHENYL)2OXOFURAN3YLIDENE)METHYL)BENZOATE
MFCD03725710
STK064076
ZINC000013897382
ZINC13897382
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