methyl 2-[4-oxidanylidene-7-(trifluoromethyl)quinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-7-(trifluoromethyl)quinolin-1-yl]ethanoate Openeye Name: methyl 2-[4-oxo-7-(trifluoromethyl)-1-quinolyl]acetate CAS Name: 2-[4-oxo-7-(trifluoromethyl)-1-quinolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-7-(trifluoromethyl)quinolin-1-yl]acetate Traditional Name: 2-[4-keto-7-(trifluoromethyl)-1-quinolyl]acetic acid methyl ester Formula: C13H10F3NO3 MolecularWeight: 285.21861

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C=CC(=O)C2=C1C=C(C=C2)C(F)(F)F

Isomeric SMILES

COC(=O)CN1C=CC(=O)C2=C1C=C(C=C2)C(F)(F)F

InChI

InChI=1S/C13H10F3NO3/c1-20-12(19)7-17-5-4-11(18)9-3-2-8(6-10(9)17)13(14,15)16/h2-6H,7H2,1H3