7-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-6-fluoranyl-4-oxidanylidene-1-quinolin-5-yl-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 7-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-6-fluoranyl-4-oxidanylidene-1-quinolin-5-yl-1,8-naphthyridine-3-carboxylic acid Openeye Name: 7-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-6-fluoro-4-oxo-1-(5-quinolyl)-1,8-naphthyridine-3-carboxylic acid CAS Name: 7-[(3S,5R)-3,5-dimethyl-1-piperazinyl]-6-fluoro-4-oxo-1-(5-quinolinyl)-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 7-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-6-fluoro-4-oxo-1-quinolin-5-yl-1,8-naphthyridine-3-carboxylic acid Traditional Name: 7-[(3S,5R)-3,5-dimethylpiperazino]-6-fluoro-4-keto-1-(5-quinolyl)-1,8-naphthyridine-3-carboxylic acid Formula: C24H22FN5O3 MolecularWeight: 447.461583

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=C(C=C3C(=O)C(=CN(C3=N2)C4=CC=CC5=C4C=CC=N5)C(=O)O)F

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1)C)C2=C(C=C3C(=O)C(=CN(C3=N2)C4=CC=CC5=C4C=CC=N5)C(=O)O)F

InChI

InChI=1S/C24H22FN5O3/c1-13-10-29(11-14(2)27-13)23-18(25)9-16-21(31)17(24(32)33)12-30(22(16)28-23)20-7-3-6-19-15(20)5-4-8-26-19/h3-9,12-14,27H,10-11H2,1-2H3,(H,32,33)/t13-,14+