1-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]pyrrolidine-2,5-dione Openeye Name: 1-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]pyrrolidine-2,5-dione CAS Name: 1-[[4-(3-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]pyrrolidine-2,5-dione IUPAC Name: 1-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]pyrrolidine-2,5-dione Traditional Name: 1-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]pyrrolidine-2,5-quinone Formula: C15H19FN3O4S+ MolecularWeight: 356.392463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18FN3O4S/c16-12-2-1-3-13(10-12)24(22,23)18-8-6-17(7-9-18)11-19-14(20)4-5-15(19)21/h1-3,10H,4-9,11H2/p+1