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

Systemtic Name: 1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-N-(2-methylpropyl)-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 1-ethyl-6-fluoro-N-isobutyl-7-(4-methylpiperazin-4-ium-1-yl)-4-oxo-quinoline-3-carboxamide CAS Name: 1-ethyl-6-fluoro-7-(4-methyl-1-piperazin-4-iumyl)-N-(2-methylpropyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-N-(2-methylpropyl)-4-oxoquinoline-3-carboxamide Traditional Name: 1-ethyl-6-fluoro-N-isobutyl-4-keto-7-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxamide Formula: C21H30FN4O2+ MolecularWeight: 389.486903

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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(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H29FN4O2/c1-5-25-13-16(21(28)23-12-14(2)3)20(27)15-10-17(22)19(11-18(15)25)26-8-6-24(4)7-9-26/h10-11,13-14H,5-9,12H2,1-4H3,(H,23,28)/p+1