Vitas-M small molecule compound
(2Z)-2-{3-methoxy-4-[(2,4,6-trichlorophenoxy)methyl]benzylidene}-3,4-dihydronaphthalen-1(2H)-one
Catalog ID
STK017049
SMILES COc1cc(ccc1COc1c(Cl)cc(cc1Cl)Cl)/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 C25H19Cl3O3 MW 473.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19Cl3O3/c1-30-23-11-15(10-17-9-8-16-4-2-3-5-20(16)24(17)29)6-7-18(23)14-31-25-21(27)12-19(26)13-22(25)28/h2-7,10-13H,8-9,14H2,1H3/b17-10-InChIKey
STZJVIIUTUOOBT-YVLHZVERSA-NSynonyms
(2Z)2((3methoxy4((246trichlorophenoxy)methyl)phenyl)methylidene)34dihydronaphthalen1one
(2Z)2(3METHOXY4((246TRICHLOROPHENOXY)METHYL)BENZYLIDENE)34DIHYDRONAPHTHALEN1(2H)ONE
COC1=C(C=CC(=C1)C=C2CCC3=CC=CC=C3C2=O)COC4=C(C=C(C=C4Cl)Cl)Cl
COc1cc(ccc1COc1c(Cl)cc(cc1Cl)Cl)C=C1CCc2c(C1=O)cccc2
InChI=1SC25H19Cl3O3c130231115(10179816423520(16)24(17)29)6718(23)14312521(27)1219(26)1322(25)28h271013H8914H21H3b1710
MFCD03562240
STK017049
ZINC000008984749
ZINC08984749
ZINC8984749
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