Vitas-M small molecule compound

(2Z)-2-(3-methylbenzylidene)-6-{[(2E)-3-phenylprop-2-en-1-yl]oxy}-1-benzofuran-3(2H)-one

Catalog ID
STK992535
SMILES Cc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OC/C=C/c1ccccc1

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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 C25H20O3 MW 368.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20O3/c1-18-7-5-10-20(15-18)16-24-25(26)22-13-12-21(17-23(22)28-24)27-14-6-11-19-8-3-2-4-9-19/h2-13,15-17H,14H2,1H3/b11-6+,24-16-
InChIKey
PRWXEKJRNCOPNY-WAHJLDKCSA-N
Synonyms
929505-97-5
(2Z)2((3methylphenyl)methylidene)6((E)3phenylprop2enoxy)1benzofuran3one
(2Z)2(3methylbenzylidene)6(((2E)3phenylprop2en1yl)oxy)1benzofuran3(2H)one
(Z)6(cinnamyloxy)2(3methylbenzylidene)benzofuran3(2H)one
6((2E)3PHENYLPROP2ENYLOXY)2((3METHYLPHENYL)METHYLENE)BENZO(B)FURAN3ONE
929505975
CC1=CC=CC(=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC=CC4=CC=CC=C4
Cc1cccc(c1)C=C1Oc2c(C1=O)ccc(c2)OCC=Cc1ccccc1
InChI=1SC25H20O3c118751020(1518)162425(26)22131221(1723(22)2824)2714611198324919h2131517H14H21H3b116+2416
MFCD09846222
ZINC000009547974
ZINC09547974
ZINC9547974

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.