[2-[[[5-(diethylsulfamoyl)-2-fluoranyl-phenyl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[[5-(diethylsulfamoyl)-2-fluoranyl-phenyl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[[5-(diethylsulfamoyl)-2-fluoro-benzoyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[[5-(diethylsulfamoyl)-2-fluorophenyl]-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[[5-(diethylsulfamoyl)-2-fluorobenzoyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[[5-(diethylsulfamoyl)-2-fluoro-benzoyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C21H29FN3O3S+ MolecularWeight: 422.536663

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)NCC2=CC=CC=C2C[NH+](C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)NCC2=CC=CC=C2C[NH+](C)C

InChI

InChI=1S/C21H28FN3O3S/c1-5-25(6-2)29(27,28)18-11-12-20(22)19(13-18)21(26)23-14-16-9-7-8-10-17(16)15-24(3)4/h7-13H,5-6,14-15H2,1-4H3,(H,23,26)/p+1