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

Systemtic Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoranyl-2-methyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-2-methyl-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 7-(3,5-dimethyl-1-piperazinyl)-6-fluoro-2-methyl-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-2-methyl-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 7-(3,5-dimethylpiperazino)-6-fluoro-4-keto-2-methyl-1H-quinoline-3-carboxylic acid Formula: C17H20FN3O3 MolecularWeight: 333.357403

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=C(C=C3C(=C2)NC(=C(C3=O)C(=O)O)C)F

Isomeric SMILES

CC1CN(CC(N1)C)C2=C(C=C3C(=C2)NC(=C(C3=O)C(=O)O)C)F

InChI

InChI=1S/C17H20FN3O3/c1-8-6-21(7-9(2)19-8)14-5-13-11(4-12(14)18)16(22)15(17(23)24)10(3)20-13/h4-5,8-9,19H,6-7H2,1-3H3,(H,20,22)(H,23,24)