N-(3-fluorophenyl)-2-[4-(3-morpholin-4-ylsulfonylphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-(3-morpholin-4-ylsulfonylphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-(3-morpholinosulfonylbenzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[4-[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-(3-morpholin-4-ylsulfonylbenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[4-(3-morpholinosulfonylbenzoyl)piperazin-1-ium-1-yl]acetamide Formula: C23H28FN4O5S+ MolecularWeight: 491.555623

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)F)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H27FN4O5S/c24-19-4-2-5-20(16-19)25-22(29)17-26-7-9-27(10-8-26)23(30)18-3-1-6-21(15-18)34(31,32)28-11-13-33-14-12-28/h1-6,15-16H,7-14,17H2,(H,25,29)/p+1