[4-fluoranyl-3-(pentylsulfamoyl)phenyl]methylazanium

Systemtic Name: [4-fluoranyl-3-(pentylsulfamoyl)phenyl]methylazanium Openeye Name: [4-fluoro-3-(pentylsulfamoyl)phenyl]methylammonium CAS Name: [4-fluoro-3-(pentylsulfamoyl)phenyl]methylammonium IUPAC Name: [4-fluoro-3-(pentylsulfamoyl)phenyl]methylazanium Traditional Name: [3-(amylsulfamoyl)-4-fluoro-benzyl]ammonium Formula: C12H20FN2O2S+ MolecularWeight: 275.362803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19FN2O2S/c1-2-3-4-7-15-18(16,17)12-8-10(9-14)5-6-11(12)13/h5-6,8,15H,2-4,7,9,14H2,1H3/p+1