6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-1-quinolin-5-yl-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-1-quinolin-5-yl-1,8-naphthyridine-3-carboxylic acid Openeye Name: 6-fluoro-4-oxo-7-piperazin-1-yl-1-(5-quinolyl)-1,8-naphthyridine-3-carboxylic acid CAS Name: 6-fluoro-4-oxo-7-(1-piperazinyl)-1-(5-quinolinyl)-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 6-fluoro-4-oxo-7-piperazin-1-yl-1-quinolin-5-yl-1,8-naphthyridine-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-piperazino-1-(5-quinolyl)-1,8-naphthyridine-3-carboxylic acid Formula: C22H18FN5O3 MolecularWeight: 419.408423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C(=O)C(=CN(C3=N2)C4=CC=CC5=C4C=CC=N5)C(=O)O)F

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=O)C(=CN(C3=N2)C4=CC=CC5=C4C=CC=N5)C(=O)O)F

InChI

InChI=1S/C22H18FN5O3/c23-16-11-14-19(29)15(22(30)31)12-28(18-5-1-4-17-13(18)3-2-6-25-17)20(14)26-21(16)27-9-7-24-8-10-27/h1-6,11-12,24H,7-10H2,(H,30,31)