2-[[5-(2-azaniumylethyl)-2-fluoranyl-phenyl]sulfonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-(2-azaniumylethyl)-2-fluoranyl-phenyl]sulfonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-(2-azaniumylethyl)-2-fluoro-phenyl]sulfonylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[5-(2-ammonioethyl)-2-fluorophenyl]sulfonylamino]ethyl-dimethylammonium IUPAC Name: 2-[[5-(2-azaniumylethyl)-2-fluorophenyl]sulfonylamino]ethyl-dimethylazanium Traditional Name: 2-[[5-(2-ammonioethyl)-2-fluoro-phenyl]sulfonylamino]ethyl-dimethyl-ammonium Formula: C12H22FN3O2S+2 MolecularWeight: 291.385383

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNS(=O)(=O)C1=C(C=CC(=C1)CC[NH3+])F

Isomeric SMILES

C[NH+](C)CCNS(=O)(=O)C1=C(C=CC(=C1)CC[NH3+])F

InChI

InChI=1S/C12H20FN3O2S/c1-16(2)8-7-15-19(17,18)12-9-10(5-6-14)3-4-11(12)13/h3-4,9,15H,5-8,14H2,1-2H3/p+2