6-fluoranyl-4-oxidanylidene-2-piperazin-1-yl-1-pyridin-3-yl-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-4-oxidanylidene-2-piperazin-1-yl-1-pyridin-3-yl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-4-oxo-2-piperazin-1-yl-1-(3-pyridyl)quinoline-3-carboxylic acid CAS Name: 6-fluoro-4-oxo-2-(1-piperazinyl)-1-(3-pyridinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-4-oxo-2-piperazin-1-yl-1-pyridin-3-ylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-2-piperazino-1-(3-pyridyl)quinoline-3-carboxylic acid Formula: C19H17FN4O3 MolecularWeight: 368.361683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C(=O)C3=C(N2C4=CN=CC=C4)C=CC(=C3)F)C(=O)O

Isomeric SMILES

C1CN(CCN1)C2=C(C(=O)C3=C(N2C4=CN=CC=C4)C=CC(=C3)F)C(=O)O

InChI

InChI=1S/C19H17FN4O3/c20-12-3-4-15-14(10-12)17(25)16(19(26)27)18(23-8-6-21-7-9-23)24(15)13-2-1-5-22-11-13/h1-5,10-11,21H,6-9H2,(H,26,27)