1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-2-heptan-3-yl-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-2-heptan-3-yl-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid Openeye Name: 1-(2,4-difluorophenyl)-2-(1-ethylpentyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid CAS Name: 1-(2,4-difluorophenyl)-6-fluoro-2-heptan-3-yl-4-oxo-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 1-(2,4-difluorophenyl)-6-fluoro-2-heptan-3-yl-4-oxo-1,8-naphthyridine-3-carboxylic acid Traditional Name: 1-(2,4-difluorophenyl)-2-(1-ethylpentyl)-6-fluoro-4-keto-1,8-naphthyridine-3-carboxylic acid Formula: C22H21F3N2O3 MolecularWeight: 418.40895

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1=C(C(=O)C2=CC(=CN=C2N1C3=C(C=C(C=C3)F)F)F)C(=O)O

Isomeric SMILES

CCCCC(CC)C1=C(C(=O)C2=CC(=CN=C2N1C3=C(C=C(C=C3)F)F)F)C(=O)O

InChI

InChI=1S/C22H21F3N2O3/c1-3-5-6-12(4-2)19-18(22(29)30)20(28)15-9-14(24)11-26-21(15)27(19)17-8-7-13(23)10-16(17)25/h7-12H,3-6H2,1-2H3,(H,29,30)