2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-methoxyphenyl)methyl]acetamide CAS Name: 2-[4-(3-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[(2-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-methoxyphenyl)methyl]acetamide Traditional Name: 2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-o-anisyl-acetamide Formula: C20H25ClN3O4S+ MolecularWeight: 438.9482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H24ClN3O4S/c1-28-19-8-3-2-5-16(19)14-22-20(25)15-23-9-11-24(12-10-23)29(26,27)18-7-4-6-17(21)13-18/h2-8,13H,9-12,14-15H2,1H3,(H,22,25)/p+1