6-fluoranyl-2-(2-methylpyrrolidin-1-yl)-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-2-(2-methylpyrrolidin-1-yl)-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-2-(2-methylpyrrolidin-1-yl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid CAS Name: 6-fluoro-2-(2-methyl-1-pyrrolidinyl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid IUPAC Name: 6-fluoro-2-(2-methylpyrrolidin-1-yl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-2-(2-methylpyrrolidino)-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Formula: C16H14F4N2O3 MolecularWeight: 358.287573

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN1C2=C(C(=O)C3=CC(=CC(=C3N2)C(F)(F)F)F)C(=O)O

Isomeric SMILES

CC1CCCN1C2=C(C(=O)C3=CC(=CC(=C3N2)C(F)(F)F)F)C(=O)O

InChI

InChI=1S/C16H14F4N2O3/c1-7-3-2-4-22(7)14-11(15(24)25)13(23)9-5-8(17)6-10(12(9)21-14)16(18,19)20/h5-7H,2-4H2,1H3,(H,21,23)(H,24,25)