2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-N-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(4-piperidinosulfonylphenyl)acetamide Formula: C23H30FN4O3S+ MolecularWeight: 461.572703

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C23H29FN4O3S/c24-21-6-2-3-7-22(21)27-16-14-26(15-17-27)18-23(29)25-19-8-10-20(11-9-19)32(30,31)28-12-4-1-5-13-28/h2-3,6-11H,1,4-5,12-18H2,(H,25,29)/p+1