[4-[[(5-bromanyl-2-methyl-phenyl)sulfonylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[[(5-bromanyl-2-methyl-phenyl)sulfonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[(5-bromo-2-methyl-phenyl)sulfonylamino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[(5-bromo-2-methylphenyl)sulfonylamino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[[(5-bromo-2-methylphenyl)sulfonylamino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [4-[[(5-bromo-2-methyl-phenyl)sulfonylamino]methyl]benzyl]-dimethyl-ammonium Formula: C17H22BrN2O2S+ MolecularWeight: 398.33778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)S(=O)(=O)NCC2=CC=C(C=C2)C[NH+](C)C

Isomeric SMILES

CC1=C(C=C(C=C1)Br)S(=O)(=O)NCC2=CC=C(C=C2)C[NH+](C)C

InChI

InChI=1S/C17H21BrN2O2S/c1-13-4-9-16(18)10-17(13)23(21,22)19-11-14-5-7-15(8-6-14)12-20(2)3/h4-10,19H,11-12H2,1-3H3/p+1