1-ethyl-6-fluoranyl-7-(5-methyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-(5-methyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-(5-methyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-7-(5-methyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-(5-methyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(5-methyl-2,5-diazabicyclo[2.2.2]octan-2-yl)quinoline-3-carboxylic acid Formula: C19H22FN3O3 MolecularWeight: 359.394683

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC4CCC3CN4C)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC4CCC3CN4C)F)C(=O)O

InChI

InChI=1S/C19H22FN3O3/c1-3-22-10-14(19(25)26)18(24)13-6-15(20)17(7-16(13)22)23-9-11-4-5-12(23)8-21(11)2/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,25,26)