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

Systemtic Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-morpholinophenyl)acetamide CAS Name: 2-[4-(3-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[2-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-morpholinophenyl)acetamide Formula: C22H28FN4O4S+ MolecularWeight: 463.545523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2N3CCOCC3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2N3CCOCC3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C22H27FN4O4S/c23-18-4-3-5-19(16-18)32(29,30)27-10-8-25(9-11-27)17-22(28)24-20-6-1-2-7-21(20)26-12-14-31-15-13-26/h1-7,16H,8-15,17H2,(H,24,28)/p+1