2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-fluorophenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-fluorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazin-1-iumyl]-N-[(2-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(2-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-fluorobenzyl)-N-methyl-acetamide Formula: C22H29FN3O5S+ MolecularWeight: 466.546163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28FN3O5S/c1-24(15-17-6-4-5-7-19(17)23)22(27)16-25-10-12-26(13-11-25)32(28,29)18-8-9-20(30-2)21(14-18)31-3/h4-9,14H,10-13,15-16H2,1-3H3/p+1