1-[2-[(4-fluorophenyl)methylsulfonyl]ethyl]piperazine-1,4-diium

Systemtic Name: 1-[2-[(4-fluorophenyl)methylsulfonyl]ethyl]piperazine-1,4-diium Openeye Name: 1-[2-[(4-fluorophenyl)methylsulfonyl]ethyl]piperazine-1,4-diium CAS Name: 1-[2-[(4-fluorophenyl)methylsulfonyl]ethyl]piperazine-1,4-diium IUPAC Name: 1-[2-[(4-fluorophenyl)methylsulfonyl]ethyl]piperazine-1,4-diium Traditional Name: 1-[2-(4-fluorobenzyl)sulfonylethyl]piperazine-1,4-diium Formula: C13H21FN2O2S+2 MolecularWeight: 288.381443

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CCS(=O)(=O)CC2=CC=C(C=C2)F

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CCS(=O)(=O)CC2=CC=C(C=C2)F

InChI

InChI=1S/C13H19FN2O2S/c14-13-3-1-12(2-4-13)11-19(17,18)10-9-16-7-5-15-6-8-16/h1-4,15H,5-11H2/p+2