6-(hydroxymethyl)-3-oxidanyl-2-[pyridin-2-yl-[[2-(trifluoromethyl)phenyl]amino]methyl]pyran-4-one

Systemtic Name: 6-(hydroxymethyl)-3-oxidanyl-2-[pyridin-2-yl-[[2-(trifluoromethyl)phenyl]amino]methyl]pyran-4-one Openeye Name: 3-hydroxy-6-(hydroxymethyl)-2-[2-pyridyl-[2-(trifluoromethyl)anilino]methyl]pyran-4-one CAS Name: 3-hydroxy-6-(hydroxymethyl)-2-[2-pyridinyl-[2-(trifluoromethyl)anilino]methyl]-4-pyranone IUPAC Name: 3-hydroxy-6-(hydroxymethyl)-2-[pyridin-2-yl-[2-(trifluoromethyl)anilino]methyl]pyran-4-one Traditional Name: 3-hydroxy-6-methylol-2-[2-pyridyl-[2-(trifluoromethyl)anilino]methyl]pyran-4-one Formula: C19H15F3N2O4 MolecularWeight: 392.32861

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)NC(C2=CC=CC=N2)C3=C(C(=O)C=C(O3)CO)O

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)NC(C2=CC=CC=N2)C3=C(C(=O)C=C(O3)CO)O

InChI

InChI=1S/C19H15F3N2O4/c20-19(21,22)12-5-1-2-6-13(12)24-16(14-7-3-4-8-23-14)18-17(27)15(26)9-11(10-25)28-18/h1-9,16,24-25,27H,10H2