1-(4-chlorophenyl)sulfonyl-4-[2-(2-fluoranylphenoxy)ethyl]piperazin-4-ium

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-[2-(2-fluoranylphenoxy)ethyl]piperazin-4-ium Openeye Name: 1-(4-chlorophenyl)sulfonyl-4-[2-(2-fluorophenoxy)ethyl]piperazin-4-ium CAS Name: 1-(4-chlorophenyl)sulfonyl-4-[2-(2-fluorophenoxy)ethyl]piperazin-4-ium IUPAC Name: 1-(4-chlorophenyl)sulfonyl-4-[2-(2-fluorophenoxy)ethyl]piperazin-4-ium Traditional Name: 1-(4-chlorophenyl)sulfonyl-4-[2-(2-fluorophenoxy)ethyl]piperazin-4-ium Formula: C18H21ClFN2O3S+ MolecularWeight: 399.887343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H20ClFN2O3S/c19-15-5-7-16(8-6-15)26(23,24)22-11-9-21(10-12-22)13-14-25-18-4-2-1-3-17(18)20/h1-8H,9-14H2/p+1