1-[3,4-bis(fluoranyl)phenyl]sulfonyl-4-propyl-piperazin-4-ium

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]sulfonyl-4-propyl-piperazin-4-ium Openeye Name: 1-(3,4-difluorophenyl)sulfonyl-4-propyl-piperazin-4-ium CAS Name: 1-(3,4-difluorophenyl)sulfonyl-4-propylpiperazin-4-ium IUPAC Name: 1-(3,4-difluorophenyl)sulfonyl-4-propylpiperazin-4-ium Traditional Name: 1-(3,4-difluorophenyl)sulfonyl-4-propyl-piperazin-4-ium Formula: C13H19F2N2O2S+ MolecularWeight: 305.363966

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C13H18F2N2O2S/c1-2-5-16-6-8-17(9-7-16)20(18,19)11-3-4-12(14)13(15)10-11/h3-4,10H,2,5-9H2,1H3/p+1