N-[(2-fluorophenyl)methyl]-N-methyl-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-N-methyl-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-[(2-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-N-[(2-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-[(2-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-(4-besylpiperazin-1-ium-1-yl)-N-(2-fluorobenzyl)-N-methyl-acetamide Formula: C20H25FN3O3S+ MolecularWeight: 406.494203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1F)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=CC=C1F)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H24FN3O3S/c1-22(15-17-7-5-6-10-19(17)21)20(25)16-23-11-13-24(14-12-23)28(26,27)18-8-3-2-4-9-18/h2-10H,11-16H2,1H3/p+1