N-[(2-chlorophenyl)methyl]-1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-1-ethyl-6-fluoranyl-7-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxo-quinoline-3-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-1-ethyl-6-fluoro-7-(4-methyl-1-piperazin-4-iumyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxoquinoline-3-carboxamide Traditional Name: N-(2-chlorobenzyl)-1-ethyl-6-fluoro-4-keto-7-(4-methylpiperazin-4-ium-1-yl)quinoline-3-carboxamide Formula: C24H27ClFN4O2+ MolecularWeight: 457.948183

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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)NCC4=CC=CC=C4Cl

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC[NH+](CC3)C)F)C(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C24H26ClFN4O2/c1-3-29-15-18(24(32)27-14-16-6-4-5-7-19(16)25)23(31)17-12-20(26)22(13-21(17)29)30-10-8-28(2)9-11-30/h4-7,12-13,15H,3,8-11,14H2,1-2H3,(H,27,32)/p+1