[2,2-dimethyl-3-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]azaniumyl]propyl]-dimethyl-azanium

Systemtic Name: [2,2-dimethyl-3-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]azaniumyl]propyl]-dimethyl-azanium Openeye Name: [2,2-dimethyl-3-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]ammonio]propyl]-dimethyl-ammonium CAS Name: [2,2-dimethyl-3-[[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonio]propyl]-dimethylammonium IUPAC Name: [2,2-dimethyl-3-[[(1S)-1-(4-methylsulfanylphenyl)ethyl]azaniumyl]propyl]-dimethylazanium Traditional Name: [2,2-dimethyl-3-[[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonio]propyl]-dimethyl-ammonium Formula: C16H30N2S+2 MolecularWeight: 282.4878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)[NH2+]CC(C)(C)C[NH+](C)C

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)SC)[NH2+]CC(C)(C)C[NH+](C)C

InChI

InChI=1S/C16H28N2S/c1-13(14-7-9-15(19-6)10-8-14)17-11-16(2,3)12-18(4)5/h7-10,13,17H,11-12H2,1-6H3/p+2/t13-/m0/s1