methyl 3,3,3-tris(fluoranyl)-2-oxidanyl-2-quinolin-6-yl-propanoate

Systemtic Name: methyl 3,3,3-tris(fluoranyl)-2-oxidanyl-2-quinolin-6-yl-propanoate Openeye Name: methyl 3,3,3-trifluoro-2-hydroxy-2-(6-quinolyl)propanoate CAS Name: 3,3,3-trifluoro-2-hydroxy-2-(6-quinolinyl)propanoic acid methyl ester IUPAC Name: methyl 3,3,3-trifluoro-2-hydroxy-2-quinolin-6-ylpropanoate Traditional Name: 3,3,3-trifluoro-2-hydroxy-2-(6-quinolyl)propionic acid methyl ester Formula: C13H10F3NO3 MolecularWeight: 285.21861

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC2=C(C=C1)N=CC=C2)(C(F)(F)F)O

Isomeric SMILES

COC(=O)C(C1=CC2=C(C=C1)N=CC=C2)(C(F)(F)F)O

InChI

InChI=1S/C13H10F3NO3/c1-20-11(18)12(19,13(14,15)16)9-4-5-10-8(7-9)3-2-6-17-10/h2-7,19H,1H3