N-(3-chloranyl-4-fluoranyl-phenyl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-(4-methylsulfonyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-(4-mesylpiperazin-1-ium-1-yl)acetamide Formula: C13H18ClFN3O3S+ MolecularWeight: 350.816723

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CS(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C13H17ClFN3O3S/c1-22(20,21)18-6-4-17(5-7-18)9-13(19)16-10-2-3-12(15)11(14)8-10/h2-3,8H,4-7,9H2,1H3,(H,16,19)/p+1