Vitas-M small molecule compound
4-({2-bromo-4-[(E)-2-cyano-2-(3-fluorophenyl)ethenyl]phenoxy}methyl)benzoic acid
Catalog ID
STK201604
SMILES N#C/C(=C/c1ccc(c(c1)Br)OCc1ccc(cc1)C(=O)O)/c1cccc(c1)F
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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 C23H15BrFNO3 MW 452.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15BrFNO3/c24-21-11-16(10-19(13-26)18-2-1-3-20(25)12-18)6-9-22(21)29-14-15-4-7-17(8-5-15)23(27)28/h1-12H,14H2,(H,27,28)/b19-10-InChIKey
MLXPZXPPRLGORZ-GRSHGNNSSA-NSynonyms
4((2BROMANYL4((E)2CYANO2(3FLUOROPHENYL)ETHENYL)PHENOXY)METHYL)BENZOICACID
4((2BROMO4((E)2CYANO2(3FLUOROPHENYL)ETHENYL)PHENOXY)METHYL)BENZOICACID
4((2BROMO4((E)2CYANO2(3FLUOROPHENYL)VINYL)PHENOXY)METHYL)BENZOICACID
4((2BROMO4(2CYANO2(3FLUOROPHENYL)VINYL)PHENOXY)METHYL)BENZOICACID
C1=CC(=CC(=C1)F)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)O)Br)C#N
InChI=1SC23H15BrFNO3c24211116(1019(1326)1821320(25)1218)6922(21)2914154717(8515)23(27)28h112H14H2(H2728)b1910
MFCD06626608
N#CC(=Cc1ccc(c(c1)Br)OCc1ccc(cc1)C(=O)O)c1cccc(c1)F
ZINC000012393085
ZINC12393085
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