Vitas-M small molecule compound
(2E)-2-{3-[(4-fluorophenoxy)methyl]-4-methoxybenzylidene}-3,4-dihydronaphthalen-1(2H)-one
Catalog ID
STK831699
SMILES COc1ccc(cc1COc1ccc(cc1)F)/C=C/1\CCc2c(C1=O)cccc2
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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 C25H21FO3 MW 388.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21FO3/c1-28-24-13-6-17(15-20(24)16-29-22-11-9-21(26)10-12-22)14-19-8-7-18-4-2-3-5-23(18)25(19)27/h2-6,9-15H,7-8,16H2,1H3/b19-14+InChIKey
PBYKDHBMTIGAPX-XMHGGMMESA-NSynonyms
(2E)2((3((4FLUOROPHENOXY)METHYL)4METHOXYPHENYL)METHYLIDENE)34DIHYDRONAPHTHALEN1ONE
(2E)2(3((4fluorophenoxy)methyl)4methoxybenzylidene)34dihydronaphthalen1(2H)one
(E)2(3((4fluorophenoxy)methyl)4methoxybenzylidene)34dihydronaphthalen1(2H)one
2(3((4FLUOROPHENOXY)METHYL)4METHOXYBENZYLIDENE)34DIHYDRO1(2H)NAPHTHALENONE
COC1=C(C=C(C=C1)C=C2CCC3=CC=CC=C3C2=O)COC4=CC=C(C=C4)F
COc1ccc(cc1COc1ccc(cc1)F)C=C1CCc2c(C1=O)cccc2
InChI=1SC25H21FO3c1282413617(1520(24)16292211921(26)101222)14198718423523(18)25(19)27h26915H7816H21H3b1914+
MFCD02237942
ZINC000000985691
ZINC00985691
ZINC985691
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