1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-quinoline-3-carboxamide dichloride

Systemtic Name: 1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-quinoline-3-carboxamide dichloride Openeye Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-N-(2-morpholin-4-ium-4-ylethyl)-4-oxo-quinoline-3-carboxamide dichloride CAS Name: 1-ethyl-6-fluoro-7-(4-methyl-1-piperazin-4-iumyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-4-oxo-3-quinolinecarboxamide dichloride IUPAC Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-N-(2-morpholin-4-ium-4-ylethyl)-4-oxoquinoline-3-carboxamide dichloride Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(4-methylpiperazin-4-ium-1-yl)-N-(2-morpholin-4-ium-4-ylethyl)quinoline-3-carboxamide dichloride Formula: C23H34Cl2FN5O3 MolecularWeight: 518.452163

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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+]4CCOCC4.[Cl-].[Cl-]

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC[NH+](CC3)C)F)C(=O)NCC[NH+]4CCOCC4.[Cl-].[Cl-]

InChI

InChI=1S/C23H32FN5O3.2ClH/c1-3-28-16-18(23(31)25-4-5-27-10-12-32-13-11-27)22(30)17-14-19(24)21(15-20(17)28)29-8-6-26(2)7-9-29;;/h14-16H,3-13H2,1-2H3,(H,25,31);2*1H