(4-ethylpiperazin-4-ium-1-yl)-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-(4-fluoro-3-morpholinosulfonyl-phenyl)methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[4-fluoro-3-(4-morpholinylsulfonyl)phenyl]methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-(4-fluoro-3-morpholinosulfonyl-phenyl)methanone Formula: C17H25FN3O4S+ MolecularWeight: 386.461503

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H24FN3O4S/c1-2-19-5-7-20(8-6-19)17(22)14-3-4-15(18)16(13-14)26(23,24)21-9-11-25-12-10-21/h3-4,13H,2,5-12H2,1H3/p+1