7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoranyl-3-(4-methylphenyl)sulfonyl-1-propyl-quinolin-4-one

Systemtic Name: 7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoranyl-3-(4-methylphenyl)sulfonyl-1-propyl-quinolin-4-one Openeye Name: 7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-1-propyl-3-(p-tolylsulfonyl)quinolin-4-one CAS Name: 7-(4-ethyl-1-piperazin-4-iumyl)-6-fluoro-3-(4-methylphenyl)sulfonyl-1-propyl-4-quinolinone IUPAC Name: 7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-3-(4-methylphenyl)sulfonyl-1-propylquinolin-4-one Traditional Name: 7-(4-ethylpiperazin-4-ium-1-yl)-6-fluoro-1-propyl-3-tosyl-4-quinolone Formula: C25H31FN3O3S+ MolecularWeight: 472.595343

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC[NH+](CC3)CC)F)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CC[NH+](CC3)CC)F)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H30FN3O3S/c1-4-10-29-17-24(33(31,32)19-8-6-18(3)7-9-19)25(30)20-15-21(26)23(16-22(20)29)28-13-11-27(5-2)12-14-28/h6-9,15-17H,4-5,10-14H2,1-3H3/p+1