2-(4-ethanoylpiperazin-1-ium-1-yl)-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-ethanoylpiperazin-1-ium-1-yl)-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-1-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-1-[4-(4-fluorophenyl)sulfonylpiperazino]ethanone Formula: C18H26FN4O4S+ MolecularWeight: 413.486843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H25FN4O4S/c1-15(24)21-8-6-20(7-9-21)14-18(25)22-10-12-23(13-11-22)28(26,27)17-4-2-16(19)3-5-17/h2-5H,6-14H2,1H3/p+1