1-(4-fluorophenyl)sulfonyl-4-[2-(2-methylphenoxy)ethyl]piperazin-4-ium

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-4-[2-(2-methylphenoxy)ethyl]piperazin-4-ium Openeye Name: 1-(4-fluorophenyl)sulfonyl-4-[2-(2-methylphenoxy)ethyl]piperazin-4-ium CAS Name: 1-(4-fluorophenyl)sulfonyl-4-[2-(2-methylphenoxy)ethyl]piperazin-4-ium IUPAC Name: 1-(4-fluorophenyl)sulfonyl-4-[2-(2-methylphenoxy)ethyl]piperazin-4-ium Traditional Name: 1-(4-fluorophenyl)sulfonyl-4-[2-(2-methylphenoxy)ethyl]piperazin-4-ium Formula: C19H24FN2O3S+ MolecularWeight: 379.468863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=CC=C1OCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H23FN2O3S/c1-16-4-2-3-5-19(16)25-15-14-21-10-12-22(13-11-21)26(23,24)18-8-6-17(20)7-9-18/h2-9H,10-15H2,1H3/p+1