1-(2-chlorophenyl)sulfonyl-4-[(3-fluorophenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(2-chlorophenyl)sulfonyl-4-[(3-fluorophenyl)methyl]piperazin-4-ium Openeye Name: 1-(2-chlorophenyl)sulfonyl-4-[(3-fluorophenyl)methyl]piperazin-4-ium CAS Name: 1-(2-chlorophenyl)sulfonyl-4-[(3-fluorophenyl)methyl]piperazin-4-ium IUPAC Name: 1-(2-chlorophenyl)sulfonyl-4-[(3-fluorophenyl)methyl]piperazin-4-ium Traditional Name: 1-(2-chlorophenyl)sulfonyl-4-(3-fluorobenzyl)piperazin-4-ium Formula: C17H19ClFN2O2S+ MolecularWeight: 369.861363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H18ClFN2O2S/c18-16-6-1-2-7-17(16)24(22,23)21-10-8-20(9-11-21)13-14-4-3-5-15(19)12-14/h1-7,12H,8-11,13H2/p+1