Vitas-M small molecule compound
[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]{3-[(4-nitrophenoxy)methyl]phenyl}methanone
Catalog ID
STK311778
SMILES O=C(N1N=CCC1(O)C(F)(F)F)c1cccc(c1)COc1ccc(cc1)[N+](=O)[O-]
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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 C18H14F3N3O5 MW 409.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14F3N3O5/c19-18(20,21)17(26)8-9-22-23(17)16(25)13-3-1-2-12(10-13)11-29-15-6-4-14(5-7-15)24(27)28/h1-7,9-10,26H,8,11H2InChIKey
MZGGONGSBZQBMF-UHFFFAOYSA-NSynonyms
832727-93-2(5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)(3((4nitrophenoxy)methyl)phenyl)methanone
(5hydroxy5(trifluoromethyl)4Hpyrazol1yl)(3((4nitrophenoxy)methyl)phenyl)methanone
832727932
C1C=NN(C1(C(F)(F)F)O)C(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC18H14F3N3O5c1918(2021)17(26)892223(17)16(25)1331212(1013)1129156414(5715)24(27)28h1791026H811H2
MFCD04140008
O=C(N1N=CCC1(O)C(F)(F)F)c1cccc(c1)COc1ccc(cc1)(N+)(=O)(O)
ZINC000006925911
ZINC000006925913
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