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

Systemtic Name: 6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-1-propyl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-4-oxo-7-piperazin-1-yl-1-propyl-quinoline-3-carboxylic acid CAS Name: 6-fluoro-4-oxo-7-(1-piperazinyl)-1-propyl-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-4-oxo-7-piperazin-1-yl-1-propylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-piperazino-1-propyl-quinoline-3-carboxylic acid Formula: C17H20FN3O3 MolecularWeight: 333.357403

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCNCC3)F)C(=O)O

Isomeric SMILES

CCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCNCC3)F)C(=O)O

InChI

InChI=1S/C17H20FN3O3/c1-2-5-21-10-12(17(23)24)16(22)11-8-13(18)15(9-14(11)21)20-6-3-19-4-7-20/h8-10,19H,2-7H2,1H3,(H,23,24)