Vitas-M small molecule compound
(2E)-1-(1,3-benzodioxol-5-yl)-3-{[4-(trifluoromethoxy)phenyl]amino}prop-2-en-1-one
Catalog ID
STK902294
SMILES O=C(c1ccc2c(c1)OCO2)/C=C/Nc1ccc(cc1)OC(F)(F)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 C17H12F3NO4 MW 351.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12F3NO4/c18-17(19,20)25-13-4-2-12(3-5-13)21-8-7-14(22)11-1-6-15-16(9-11)24-10-23-15/h1-9,21H,10H2/b8-7+InChIKey
UMQQSEMOOPGKFA-BQYQJAHWSA-NSynonyms
(2E)1(13benzodioxol5yl)3((4(trifluoromethoxy)phenyl)amino)prop2en1one
(E)1(13benzodioxol5yl)3(4(trifluoromethoxy)anilino)prop2en1one
C1OC2=C(O1)C=C(C=C2)C(=O)C=CNC3=CC=C(C=C3)OC(F)(F)F
InChI=1SC17H12F3NO4c1817(1920)25134212(3513)218714(22)11161516(911)24102315h1921H10H2b87+
MFCD18174820
O=C(c1ccc2c(c1)OCO2)C=CNc1ccc(cc1)OC(F)(F)F
ZINC000044842716
ZINC44842716
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