diethyl-[2-[[1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-quinolin-3-yl]carbonylamino]ethyl]azanium

Systemtic Name: diethyl-[2-[[1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-quinolin-3-yl]carbonylamino]ethyl]azanium Openeye Name: diethyl-[2-[[1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxo-quinoline-3-carbonyl]amino]ethyl]ammonium CAS Name: diethyl-[2-[[[1-ethyl-6-fluoro-7-(4-methyl-1-piperazin-4-iumyl)-4-oxo-3-quinolinyl]-oxomethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[[1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxoquinoline-3-carbonyl]amino]ethyl]azanium Traditional Name: diethyl-[2-[[1-ethyl-6-fluoro-4-keto-7-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carbonyl]amino]ethyl]ammonium Formula: C23H36FN5O2+2 MolecularWeight: 433.562643

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC[NH+](CC3)C)F)C(=O)NCC[NH+](CC)CC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC[NH+](CC3)C)F)C(=O)NCC[NH+](CC)CC

InChI

InChI=1S/C23H34FN5O2/c1-5-27(6-2)9-8-25-23(31)18-16-28(7-3)20-15-21(19(24)14-17(20)22(18)30)29-12-10-26(4)11-13-29/h14-16H,5-13H2,1-4H3,(H,25,31)/p+2