(3-bromophenyl)methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium

Systemtic Name: (3-bromophenyl)methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Openeye Name: (3-bromophenyl)methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium CAS Name: (3-bromophenyl)methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium IUPAC Name: (3-bromophenyl)methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Traditional Name: (3-bromobenzyl)-[(1S)-1-(4-mesylphenyl)ethyl]-methyl-ammonium Formula: C17H21BrNO2S+ MolecularWeight: 383.32314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20BrNO2S/c1-13(15-7-9-17(10-8-15)22(3,20)21)19(2)12-14-5-4-6-16(18)11-14/h4-11,13H,12H2,1-3H3/p+1/t13-/m0/s1