6-fluoranyl-7-(1-methylpiperazin-1-ium-1-yl)-4-oxidanylidene-1-pyridin-3-yl-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-7-(1-methylpiperazin-1-ium-1-yl)-4-oxidanylidene-1-pyridin-3-yl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-7-(1-methylpiperazin-1-ium-1-yl)-4-oxo-1-(3-pyridyl)quinoline-3-carboxylic acid CAS Name: 6-fluoro-7-(1-methyl-1-piperazin-1-iumyl)-4-oxo-1-(3-pyridinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-7-(1-methylpiperazin-1-ium-1-yl)-4-oxo-1-pyridin-3-ylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-(1-methylpiperazin-1-ium-1-yl)-1-(3-pyridyl)quinoline-3-carboxylic acid Formula: C20H20FN4O3+ MolecularWeight: 383.396203

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CN=CC=C4)F

Isomeric SMILES

C[N+]1(CCNCC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CN=CC=C4)F

InChI

InChI=1S/C20H19FN4O3/c1-25(7-5-22-6-8-25)18-10-17-14(9-16(18)21)19(26)15(20(27)28)12-24(17)13-3-2-4-23-11-13/h2-4,9-12,22H,5-8H2,1H3/p+1