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

Systemtic Name: 6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-1-quinolin-6-yl-1,8-naphthyridine-3-carboxylic acid Openeye Name: 6-fluoro-4-oxo-7-piperazin-1-yl-1-(6-quinolyl)-1,8-naphthyridine-3-carboxylic acid CAS Name: 6-fluoro-4-oxo-7-(1-piperazinyl)-1-(6-quinolinyl)-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 6-fluoro-4-oxo-7-piperazin-1-yl-1-quinolin-6-yl-1,8-naphthyridine-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-piperazino-1-(6-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=CC5=C(C=C4)N=CC=C5)C(=O)O)F

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=O)C(=CN(C3=N2)C4=CC5=C(C=C4)N=CC=C5)C(=O)O)F

InChI

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