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

Systemtic Name: 1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-N-phenethyl-quinoline-3-carboxamide Openeye Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxo-N-phenethyl-quinoline-3-carboxamide CAS Name: 1-ethyl-6-fluoro-7-(4-methyl-1-piperazin-4-iumyl)-4-oxo-N-phenethyl-3-quinolinecarboxamide IUPAC Name: 1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxo-N-phenethylquinoline-3-carboxamide Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(4-methylpiperazin-4-ium-1-yl)-N-phenethyl-quinoline-3-carboxamide Formula: C25H30FN4O2+ MolecularWeight: 437.529703

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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)NCCC4=CC=CC=C4

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC[NH+](CC3)C)F)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H29FN4O2/c1-3-29-17-20(25(32)27-10-9-18-7-5-4-6-8-18)24(31)19-15-21(26)23(16-22(19)29)30-13-11-28(2)12-14-30/h4-8,15-17H,3,9-14H2,1-2H3,(H,27,32)/p+1