Vitas-M small molecule compound
3-(3-nitrophenyl)-4-[2-(trifluoromethyl)phenyl]-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Catalog ID
STK784296
SMILES O=C1CC(c2ccccc2C(F)(F)F)c2c(O1)[nH]nc2c1cccc(c1)[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 C19H12F3N3O4 MW 403.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12F3N3O4/c20-19(21,22)14-7-2-1-6-12(14)13-9-15(26)29-18-16(13)17(23-24-18)10-4-3-5-11(8-10)25(27)28/h1-8,13H,9H2,(H,23,24)InChIKey
ZGGQKNAEIGWHBS-UHFFFAOYSA-NSynonyms
3(3NITROPHENYL)4(2(TRIFLUOROMETHYL)PHENYL)45DIHYDRO2HPYRANO(23C)PYRAZOL6ONE
3(3nitrophenyl)4(2(trifluoromethyl)phenyl)45dihydropyrano(23c)pyrazol6(1H)one
C1C(C2=C(NN=C2OC1=O)C3=CC(=CC=C3)(N+)(=O)(O))C4=CC=CC=C4C(F)(F)F
InChI=1SC19H12F3N3O4c2019(2122)14721612(14)13915(26)291816(13)17(232418)1043511(810)25(27)28h1813H9H2(H2324)
MFCD07021822
O=C1CC(c2ccccc2C(F)(F)F)c2c(O1)(nH)nc2c1cccc(c1)(N+)(=O)(O)
ZINC000004626312
ZINC000004626313
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