1-tert-butyl-6-fluoranyl-7-[2-(4-methylpiperazin-1-yl)pyrrolidin-1-yl]-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 1-tert-butyl-6-fluoranyl-7-[2-(4-methylpiperazin-1-yl)pyrrolidin-1-yl]-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid Openeye Name: 1-tert-butyl-6-fluoro-7-[2-(4-methylpiperazin-1-yl)pyrrolidin-1-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid CAS Name: 1-tert-butyl-6-fluoro-7-[2-(4-methyl-1-piperazinyl)-1-pyrrolidinyl]-4-oxo-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 1-tert-butyl-6-fluoro-7-[2-(4-methylpiperazin-1-yl)pyrrolidin-1-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid Traditional Name: 1-tert-butyl-6-fluoro-4-keto-7-[2-(4-methylpiperazino)pyrrolidino]-1,8-naphthyridine-3-carboxylic acid Formula: C22H30FN5O3 MolecularWeight: 431.503703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=O)C2=CC(=C(N=C21)N3CCCC3N4CCN(CC4)C)F)C(=O)O

Isomeric SMILES

CC(C)(C)N1C=C(C(=O)C2=CC(=C(N=C21)N3CCCC3N4CCN(CC4)C)F)C(=O)O

InChI

InChI=1S/C22H30FN5O3/c1-22(2,3)28-13-15(21(30)31)18(29)14-12-16(23)20(24-19(14)28)27-7-5-6-17(27)26-10-8-25(4)9-11-26/h12-13,17H,5-11H2,1-4H3,(H,30,31)