1-cyclopropyl-7-(4-dodecyl-1-methyl-piperazin-1-ium-1-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-(4-dodecyl-1-methyl-piperazin-1-ium-1-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(4-dodecyl-1-methyl-piperazin-1-ium-1-yl)-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(4-dodecyl-1-methyl-1-piperazin-1-iumyl)-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(4-dodecyl-1-methylpiperazin-1-ium-1-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-(4-lauryl-1-methyl-piperazin-1-ium-1-yl)quinoline-3-carboxylic acid Formula: C30H45FN3O3+ MolecularWeight: 514.695003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1CC[N+](CC1)(C)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CCCCCCCCCCCCN1CC[N+](CC1)(C)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C30H44FN3O3/c1-3-4-5-6-7-8-9-10-11-12-15-32-16-18-34(2,19-17-32)28-21-27-24(20-26(28)31)29(35)25(30(36)37)22-33(27)23-13-14-23/h20-23H,3-19H2,1-2H3/p+1