8-azanyl-6-fluoranyl-1-(4-fluorophenyl)-7-(1-methylpiperidin-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-azanyl-6-fluoranyl-1-(4-fluorophenyl)-7-(1-methylpiperidin-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-amino-6-fluoro-1-(4-fluorophenyl)-7-(1-methyl-4-piperidyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-amino-6-fluoro-1-(4-fluorophenyl)-7-(1-methyl-4-piperidinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-amino-6-fluoro-1-(4-fluorophenyl)-7-(1-methylpiperidin-4-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-amino-6-fluoro-1-(4-fluorophenyl)-4-keto-7-(1-methyl-4-piperidyl)quinoline-3-carboxylic acid Formula: C22H21F2N3O3 MolecularWeight: 413.417246

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2=C(C=C3C(=C2N)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

Isomeric SMILES

CN1CCC(CC1)C2=C(C=C3C(=C2N)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

InChI

InChI=1S/C22H21F2N3O3/c1-26-8-6-12(7-9-26)18-17(24)10-15-20(19(18)25)27(11-16(21(15)28)22(29)30)14-4-2-13(23)3-5-14/h2-5,10-12H,6-9,25H2,1H3,(H,29,30)