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

Systemtic Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(4-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: 2-[4-(2-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[(4-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide Traditional Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-p-anisyl-acetamide Formula: C20H25FN3O4S+ MolecularWeight: 422.493603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H24FN3O4S/c1-28-17-8-6-16(7-9-17)14-22-20(25)15-23-10-12-24(13-11-23)29(26,27)19-5-3-2-4-18(19)21/h2-9H,10-15H2,1H3,(H,22,25)/p+1