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

Systemtic Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[4-(2-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-pyrrolidinophenyl)acetamide Formula: C22H28FN4O3S+ MolecularWeight: 447.546123

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C22H27FN4O3S/c23-20-5-1-2-6-21(20)31(29,30)27-15-13-25(14-16-27)17-22(28)24-18-7-9-19(10-8-18)26-11-3-4-12-26/h1-2,5-10H,3-4,11-17H2,(H,24,28)/p+1