2-[3-[butyl(methyl)sulfamoyl]-4-fluoranyl-phenyl]ethylazanium

Systemtic Name: 2-[3-[butyl(methyl)sulfamoyl]-4-fluoranyl-phenyl]ethylazanium Openeye Name: 2-[3-[butyl(methyl)sulfamoyl]-4-fluoro-phenyl]ethylammonium CAS Name: 2-[3-[butyl(methyl)sulfamoyl]-4-fluorophenyl]ethylammonium IUPAC Name: 2-[3-[butyl(methyl)sulfamoyl]-4-fluorophenyl]ethylazanium Traditional Name: 2-[3-[butyl(methyl)sulfamoyl]-4-fluoro-phenyl]ethylammonium Formula: C13H22FN2O2S+ MolecularWeight: 289.389383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21FN2O2S/c1-3-4-9-16(2)19(17,18)13-10-11(7-8-15)5-6-12(13)14/h5-6,10H,3-4,7-9,15H2,1-2H3/p+1