1-tert-butyl-6-fluoranyl-2-octyl-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 1-tert-butyl-6-fluoranyl-2-octyl-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid Openeye Name: 1-tert-butyl-6-fluoro-2-octyl-4-oxo-1,8-naphthyridine-3-carboxylic acid CAS Name: 1-tert-butyl-6-fluoro-2-octyl-4-oxo-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 1-tert-butyl-6-fluoro-2-octyl-4-oxo-1,8-naphthyridine-3-carboxylic acid Traditional Name: 1-tert-butyl-6-fluoro-4-keto-2-octyl-1,8-naphthyridine-3-carboxylic acid Formula: C21H29FN2O3 MolecularWeight: 376.464963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=O)C2=CC(=CN=C2N1C(C)(C)C)F)C(=O)O

Isomeric SMILES

CCCCCCCCC1=C(C(=O)C2=CC(=CN=C2N1C(C)(C)C)F)C(=O)O

InChI

InChI=1S/C21H29FN2O3/c1-5-6-7-8-9-10-11-16-17(20(26)27)18(25)15-12-14(22)13-23-19(15)24(16)21(2,3)4/h12-13H,5-11H2,1-4H3,(H,26,27)