1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-7-(5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)-4-oxidanylidene-2,3-dihydroquinoline-3-carboxylic acid

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-7-(5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)-4-oxidanylidene-2,3-dihydroquinoline-3-carboxylic acid Openeye Name: 1-(2,4-difluorophenyl)-6-fluoro-7-(5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)-4-oxo-2,3-dihydroquinoline-3-carboxylic acid CAS Name: 1-(2,4-difluorophenyl)-6-fluoro-7-(5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)-4-oxo-2,3-dihydroquinoline-3-carboxylic acid IUPAC Name: 1-(2,4-difluorophenyl)-6-fluoro-7-(5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)-4-oxo-2,3-dihydroquinoline-3-carboxylic acid Traditional Name: 1-(2,4-difluorophenyl)-6-fluoro-4-keto-7-(5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)-2,3-dihydroquinoline-3-carboxylic acid Formula: C22H20F3N3O3 MolecularWeight: 431.40771

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2CC1CN2C3=C(C=C4C(=C3)N(CC(C4=O)C(=O)O)C5=C(C=C(C=C5)F)F)F

Isomeric SMILES

CN1CC2CC1CN2C3=C(C=C4C(=C3)N(CC(C4=O)C(=O)O)C5=C(C=C(C=C5)F)F)F

InChI

InChI=1S/C22H20F3N3O3/c1-26-8-13-5-12(26)9-27(13)20-7-19-14(6-17(20)25)21(29)15(22(30)31)10-28(19)18-3-2-11(23)4-16(18)24/h2-4,6-7,12-13,15H,5,8-10H2,1H3,(H,30,31)