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

Systemtic Name: 1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-quinoline-3-carboxamide dichloride Openeye Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-quinoline-3-carboxamide dichloride CAS Name: 1-ethyl-6-fluoro-7-(4-methyl-1-piperazin-4-iumyl)-N-[3-(4-morpholin-4-iumyl)propyl]-4-oxo-3-quinolinecarboxamide dichloride IUPAC Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxoquinoline-3-carboxamide dichloride Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(4-methylpiperazin-4-ium-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)quinoline-3-carboxamide dichloride Formula: C24H36Cl2FN5O3 MolecularWeight: 532.478743

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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)NCCC[NH+]4CCOCC4.[Cl-].[Cl-]

Isomeric SMILES

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

InChI

InChI=1S/C24H34FN5O3.2ClH/c1-3-29-17-19(24(32)26-5-4-6-28-11-13-33-14-12-28)23(31)18-15-20(25)22(16-21(18)29)30-9-7-27(2)8-10-30;;/h15-17H,3-14H2,1-2H3,(H,26,32);2*1H