7-(3,5-dimethylpiperazin-1-yl)-6-fluoranyl-1-(2-fluoranyl-4-nitro-phenyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoranyl-1-(2-fluoranyl-4-nitro-phenyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-1-(2-fluoro-4-nitro-phenyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3,5-dimethyl-1-piperazinyl)-6-fluoro-1-(2-fluoro-4-nitrophenyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-1-(2-fluoro-4-nitrophenyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3,5-dimethylpiperazino)-6-fluoro-1-(2-fluoro-4-nitro-phenyl)-4-keto-quinoline-3-carboxylic acid Formula: C22H20F2N4O5 MolecularWeight: 458.414806

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=C(C=C(C=C4)[N+](=O)[O-])F)F

Isomeric SMILES

CC1CN(CC(N1)C)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=C(C=C(C=C4)[N+](=O)[O-])F)F

InChI

InChI=1S/C22H20F2N4O5/c1-11-8-26(9-12(2)25-11)20-7-19-14(6-17(20)24)21(29)15(22(30)31)10-27(19)18-4-3-13(28(32)33)5-16(18)23/h3-7,10-12,25H,8-9H2,1-2H3,(H,30,31)