N-(3-fluorophenyl)-2-[4-[3-(prop-2-enylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-[3-(prop-2-enylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[3-(allylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide CAS Name: N-(3-fluorophenyl)-2-[4-[oxo-[3-(prop-2-enylsulfamoyl)phenyl]methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-[3-(prop-2-enylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[3-(allylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide Formula: C22H26FN4O4S+ MolecularWeight: 461.529643

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

C=CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C22H25FN4O4S/c1-2-9-24-32(30,31)20-8-3-5-17(14-20)22(29)27-12-10-26(11-13-27)16-21(28)25-19-7-4-6-18(23)15-19/h2-8,14-15,24H,1,9-13,16H2,(H,25,28)/p+1