5-azanyl-1-[2,4-bis(fluoranyl)phenyl]-6,8-bis(fluoranyl)-7-(2-methyl-4-oxidanyl-pyrrolidin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-[2,4-bis(fluoranyl)phenyl]-6,8-bis(fluoranyl)-7-(2-methyl-4-oxidanyl-pyrrolidin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-(2,4-difluorophenyl)-6,8-difluoro-7-(4-hydroxy-2-methyl-pyrrolidin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-(2,4-difluorophenyl)-6,8-difluoro-7-(4-hydroxy-2-methyl-1-pyrrolidinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-(2,4-difluorophenyl)-6,8-difluoro-7-(4-hydroxy-2-methylpyrrolidin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-(2,4-difluorophenyl)-6,8-difluoro-7-(4-hydroxy-2-methyl-pyrrolidino)-4-keto-quinoline-3-carboxylic acid Formula: C21H17F4N3O4 MolecularWeight: 451.370993

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN1C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4=C(C=C(C=C4)F)F)C(=O)O)F)O

Isomeric SMILES

CC1CC(CN1C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4=C(C=C(C=C4)F)F)C(=O)O)F)O

InChI

InChI=1S/C21H17F4N3O4/c1-8-4-10(29)6-27(8)19-15(24)17(26)14-18(16(19)25)28(7-11(20(14)30)21(31)32)13-3-2-9(22)5-12(13)23/h2-3,5,7-8,10,29H,4,6,26H2,1H3,(H,31,32)