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

Systemtic Name: 2-[4-(3-ethanoylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[4-(3-acetylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-morpholino-ethanone CAS Name: 2-[4-(3-acetylphenyl)sulfonyl-1-piperazin-1-iumyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[4-(3-acetylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[4-(3-acetylphenyl)sulfonylpiperazin-1-ium-1-yl]-1-morpholino-ethanone Formula: C18H26N3O5S+ MolecularWeight: 396.48114

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N3CCOCC3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N3CCOCC3

InChI

InChI=1S/C18H25N3O5S/c1-15(22)16-3-2-4-17(13-16)27(24,25)21-7-5-19(6-8-21)14-18(23)20-9-11-26-12-10-20/h2-4,13H,5-12,14H2,1H3/p+1