6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-1-quinolin-5-yl-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-1-quinolin-5-yl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-4-oxo-7-piperazin-1-yl-1-(5-quinolyl)quinoline-3-carboxylic acid CAS Name: 6-fluoro-4-oxo-7-(1-piperazinyl)-1-(5-quinolinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-4-oxo-7-piperazin-1-yl-1-quinolin-5-ylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-piperazino-1-(5-quinolyl)quinoline-3-carboxylic acid Formula: C23H19FN4O3 MolecularWeight: 418.420363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19FN4O3/c24-17-11-15-20(12-21(17)27-9-7-25-8-10-27)28(13-16(22(15)29)23(30)31)19-5-1-4-18-14(19)3-2-6-26-18/h1-6,11-13,25H,7-10H2,(H,30,31)