2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide

Systemtic Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-morpholinocyclohexyl)methyl]acetamide CAS Name: 2-[4-(3-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[[1-(4-morpholinyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-morpholinocyclohexyl)methyl]acetamide Formula: C23H36FN4O4S+ MolecularWeight: 483.619743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)N4CCOCC4

InChI

InChI=1S/C23H35FN4O4S/c24-20-5-4-6-21(17-20)33(30,31)28-11-9-26(10-12-28)18-22(29)25-19-23(7-2-1-3-8-23)27-13-15-32-16-14-27/h4-6,17H,1-3,7-16,18-19H2,(H,25,29)/p+1