1-ethyl-6-fluoranyl-4-oxidanylidene-7-[4-(trifluoromethyl)piperidin-1-yl]quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-4-oxidanylidene-7-[4-(trifluoromethyl)piperidin-1-yl]quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-4-oxo-7-[4-(trifluoromethyl)-1-piperidyl]quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-4-oxo-7-[4-(trifluoromethyl)-1-piperidinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-4-oxo-7-[4-(trifluoromethyl)piperidin-1-yl]quinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-7-[4-(trifluoromethyl)piperidino]quinoline-3-carboxylic acid Formula: C18H18F4N2O3 MolecularWeight: 386.340733

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCC(CC3)C(F)(F)F)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCC(CC3)C(F)(F)F)F)C(=O)O

InChI

InChI=1S/C18H18F4N2O3/c1-2-23-9-12(17(26)27)16(25)11-7-13(19)15(8-14(11)23)24-5-3-10(4-6-24)18(20,21)22/h7-10H,2-6H2,1H3,(H,26,27)