Vitas-M small molecule compound
2-oxo-7-phenyl-4-({[3-(trifluoromethyl)phenyl]ammonio}methyl)-2H-chromen-6-olate
Catalog ID
STK582207
SMILES O=c1cc(C[NH2+]c2cccc(c2)C(F)(F)F)c2c(o1)cc(c(c2)[O-])c1ccccc1
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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 C23H16F3NO3 MW 411.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16F3NO3/c24-23(25,26)16-7-4-8-17(10-16)27-13-15-9-22(29)30-21-12-18(20(28)11-19(15)21)14-5-2-1-3-6-14/h1-12,27-28H,13H2InChIKey
DASIQCNZGQAZHA-UHFFFAOYSA-NSynonyms
862199-94-82oxo7phenyl4(((3(trifluoromethyl)phenyl)ammonio)methyl)2Hchromen6olate
6HYDROXY7PHENYL4(((3(TRIFLUOROMETHYL)PHENYL)AMINO)METHYL)CHROMEN2ONE
6HYDROXY7PHENYL4((3(TRIFLUOROMETHYL)ANILINO)METHYL)CHROMEN2ONE
C1=CC=C(C=C1)C2=C(C=C3C(=CC(=O)OC3=C2)CNC4=CC=CC(=C4)C(F)(F)F)O
InChI=1SC23H16F3NO3c2423(2526)1674817(1016)271315922(29)30211218(20(28)1119(15)21)145213614h1122728H13H2
MFCD05697288
O=c1cc(C(NH2+)c2cccc(c2)C(F)(F)F)c2c(o1)cc(c(c2)(O))c1ccccc1
ZINC000005490155
ZINC05490155
ZINC5490155
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