2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]ethanamide

Systemtic Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]ethanamide Openeye Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide CAS Name: 2-[4-(2-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide Traditional Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[3-(2-ketopyrrolidino)propyl]acetamide Formula: C19H28FN4O4S+ MolecularWeight: 427.513423

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

C1CC(=O)N(C1)CCCNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C19H27FN4O4S/c20-16-5-1-2-6-17(16)29(27,28)24-13-11-22(12-14-24)15-18(25)21-8-4-10-23-9-3-7-19(23)26/h1-2,5-6H,3-4,7-15H2,(H,21,25)/p+1