1-(2-chlorophenyl)sulfonyl-4-[3-(4-fluoranylphenoxy)propyl]piperazin-4-ium

Systemtic Name: 1-(2-chlorophenyl)sulfonyl-4-[3-(4-fluoranylphenoxy)propyl]piperazin-4-ium Openeye Name: 1-(2-chlorophenyl)sulfonyl-4-[3-(4-fluorophenoxy)propyl]piperazin-4-ium CAS Name: 1-(2-chlorophenyl)sulfonyl-4-[3-(4-fluorophenoxy)propyl]piperazin-4-ium IUPAC Name: 1-(2-chlorophenyl)sulfonyl-4-[3-(4-fluorophenoxy)propyl]piperazin-4-ium Traditional Name: 1-(2-chlorophenyl)sulfonyl-4-[3-(4-fluorophenoxy)propyl]piperazin-4-ium Formula: C19H23ClFN2O3S+ MolecularWeight: 413.913923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCOC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CC[NH+]1CCCOC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H22ClFN2O3S/c20-18-4-1-2-5-19(18)27(24,25)23-13-11-22(12-14-23)10-3-15-26-17-8-6-16(21)7-9-17/h1-2,4-9H,3,10-15H2/p+1