Vitas-M small molecule compound

2-methoxy-6-{(E)-[5-(4-methylphenyl)-2-oxofuran-3(2H)-ylidene]methyl}phenyl acetate

Catalog ID
STK197400
SMILES COc1cccc(c1OC(=O)C)/C=C/1\C=C(OC1=O)c1ccc(cc1)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 C21H18O5 MW 350.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18O5/c1-13-7-9-15(10-8-13)19-12-17(21(23)26-19)11-16-5-4-6-18(24-3)20(16)25-14(2)22/h4-12H,1-3H3/b17-11+
InChIKey
WLJHBWOMJJSLAZ-GZTJUZNOSA-N
Synonyms
(2METHOXY6((E)(5(4METHYLPHENYL)2OXOFURAN3YLIDENE)METHYL)PHENYL)ACETATE
(E)2methoxy6((2oxo5(ptolyl)furan3(2H)ylidene)methyl)phenylacetate
2METHOXY6((E)(5(4METHYLPHENYL)2OXOFURAN3(2H)YLIDENE)METHYL)PHENYLACETATE
ACETICACID2METHOXY6(2OXO5PTOLYLFURAN3YLIDENEMETHYL)PHENYLESTER
CC1=CC=C(C=C1)C2=CC(=CC3=C(C(=CC=C3)OC)OC(=O)C)C(=O)O2
COc1cccc(c1OC(=O)C)C=C1C=C(OC1=O)c1ccc(cc1)C
Registry IDs
MFCD02628677
ZINC000004738976
ZINC04738976
ZINC4738976

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Available files

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