Vitas-M small molecule compound
3-(biphenyl-4-yloxy)-4-oxo-8-(piperidinium-1-ylmethyl)-2-(trifluoromethyl)-4H-chromen-7-olate
Catalog ID
STK572341
SMILES [O-]c1ccc2c(c1C[NH+]1CCCCC1)oc(c(c2=O)Oc1ccc(cc1)c1ccccc1)C(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 C28H24F3NO4 MW 495.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24F3NO4/c29-28(30,31)27-26(35-20-11-9-19(10-12-20)18-7-3-1-4-8-18)24(34)21-13-14-23(33)22(25(21)36-27)17-32-15-5-2-6-16-32/h1,3-4,7-14,33H,2,5-6,15-17H2InChIKey
CXAGNERIYSBJHG-UHFFFAOYSA-NSynonyms
385395-10-8(O)c1ccc2c(c1C(NH+)1CCCCC1)oc(c(c2=O)Oc1ccc(cc1)c1ccccc1)C(F)(F)F
3(biphenyl4yloxy)4oxo8(piperidinium1ylmethyl)2(trifluoromethyl)4Hchromen7olate
385395108
4oxo3(4phenylphenoxy)8(piperidin1ium1ylmethyl)2(trifluoromethyl)chromen7olate
7HYDROXY3(4PHENYLPHENOXY)8(PIPERIDIN1YLMETHYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
7HYDROXY3(4PHENYLPHENOXY)8(PIPERIDYLMETHYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
C1CC(NH+)(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC=C(C=C4)C5=CC=CC=C5)C(F)(F)F)(O)
InChI=1SC28H24F3NO4c2928(3031)2726(352011919(101220)187314818)24(34)21131423(33)22(25(21)3627)1732155261632h13471433H2561517H2
MFCD02358736
ZINC000001770946
ZINC1770946
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