N-[4-[4-(4-fluorophenyl)piperazin-4-ium-1-yl]sulfonylphenyl]ethanamide chloride

Systemtic Name: N-[4-[4-(4-fluorophenyl)piperazin-4-ium-1-yl]sulfonylphenyl]ethanamide chloride Openeye Name: N-[4-[4-(4-fluorophenyl)piperazin-4-ium-1-yl]sulfonylphenyl]acetamide chloride CAS Name: N-[4-[[4-(4-fluorophenyl)-1-piperazin-4-iumyl]sulfonyl]phenyl]acetamide chloride IUPAC Name: N-[4-[4-(4-fluorophenyl)piperazin-4-ium-1-yl]sulfonylphenyl]acetamide chloride Traditional Name: N-[4-[4-(4-fluorophenyl)piperazin-4-ium-1-yl]sulfonylphenyl]acetamide chloride Formula: C18H21ClFN3O3S MolecularWeight: 413.894043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C3=CC=C(C=C3)F.[Cl-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C3=CC=C(C=C3)F.[Cl-]

InChI

InChI=1S/C18H20FN3O3S.ClH/c1-14(23)20-16-4-8-18(9-5-16)26(24,25)22-12-10-21(11-13-22)17-6-2-15(19)3-7-17;/h2-9H,10-13H2,1H3,(H,20,23);1H