(2-bromanyl-4-fluoranyl-phenyl)methyl-methyl-[(1S)-1-(4-sulfamoylphenyl)ethyl]azanium

Systemtic Name: (2-bromanyl-4-fluoranyl-phenyl)methyl-methyl-[(1S)-1-(4-sulfamoylphenyl)ethyl]azanium Openeye Name: (2-bromo-4-fluoro-phenyl)methyl-methyl-[(1S)-1-(4-sulfamoylphenyl)ethyl]ammonium CAS Name: (2-bromo-4-fluorophenyl)methyl-methyl-[(1S)-1-(4-sulfamoylphenyl)ethyl]ammonium IUPAC Name: (2-bromo-4-fluorophenyl)methyl-methyl-[(1S)-1-(4-sulfamoylphenyl)ethyl]azanium Traditional Name: (2-bromo-4-fluoro-benzyl)-methyl-[(1S)-1-(4-sulfamoylphenyl)ethyl]ammonium Formula: C16H19BrFN2O2S+ MolecularWeight: 402.301663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)N)[NH+](C)CC2=C(C=C(C=C2)F)Br

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)N)[NH+](C)CC2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C16H18BrFN2O2S/c1-11(12-4-7-15(8-5-12)23(19,21)22)20(2)10-13-3-6-14(18)9-16(13)17/h3-9,11H,10H2,1-2H3,(H2,19,21,22)/p+1/t11-/m0/s1