2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-morpholino-ethanone CAS Name: 2-[4-(3-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-morpholino-ethanone Formula: C16H23FN3O4S+ MolecularWeight: 372.434923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCOCC2)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCOCC2)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C16H22FN3O4S/c17-14-2-1-3-15(12-14)25(22,23)20-6-4-18(5-7-20)13-16(21)19-8-10-24-11-9-19/h1-3,12H,4-11,13H2/p+1