3-(4-ethylpiperazin-4-ium-1-yl)carbonyl-4-fluoranyl-N-methyl-benzenesulfonamide

Systemtic Name: 3-(4-ethylpiperazin-4-ium-1-yl)carbonyl-4-fluoranyl-N-methyl-benzenesulfonamide Openeye Name: 3-(4-ethylpiperazin-4-ium-1-carbonyl)-4-fluoro-N-methyl-benzenesulfonamide CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]-4-fluoro-N-methylbenzenesulfonamide IUPAC Name: 3-(4-ethylpiperazin-4-ium-1-carbonyl)-4-fluoro-N-methylbenzenesulfonamide Traditional Name: 3-(4-ethylpiperazin-4-ium-1-carbonyl)-4-fluoro-N-methyl-benzenesulfonamide Formula: C14H21FN3O3S+ MolecularWeight: 330.398243

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)NC)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)NC)F

InChI

InChI=1S/C14H20FN3O3S/c1-3-17-6-8-18(9-7-17)14(19)12-10-11(4-5-13(12)15)22(20,21)16-2/h4-5,10,16H,3,6-9H2,1-2H3/p+1