6-fluoranyl-1-(methylamino)-8-nitro-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(methylamino)-8-nitro-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(methylamino)-8-nitro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(methylamino)-8-nitro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(methylamino)-8-nitro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-1-(methylamino)-8-nitro-7-piperazino-quinoline-3-carboxylic acid Formula: C15H16FN5O5 MolecularWeight: 365.316443

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Descriptors Computed from Structure

Canonical SMILES:

CNN1C=C(C(=O)C2=CC(=C(C(=C21)[N+](=O)[O-])N3CCNCC3)F)C(=O)O

Isomeric SMILES

CNN1C=C(C(=O)C2=CC(=C(C(=C21)[N+](=O)[O-])N3CCNCC3)F)C(=O)O

InChI

InChI=1S/C15H16FN5O5/c1-17-20-7-9(15(23)24)14(22)8-6-10(16)12(13(11(8)20)21(25)26)19-4-2-18-3-5-19/h6-7,17-18H,2-5H2,1H3,(H,23,24)