2-[[(1S)-1-(3,4-dimethylphenyl)ethyl]azaniumyl]ethyl-methylsulfonyl-azanide

Systemtic Name: 2-[[(1S)-1-(3,4-dimethylphenyl)ethyl]azaniumyl]ethyl-methylsulfonyl-azanide Openeye Name: 2-[[(1S)-1-(3,4-dimethylphenyl)ethyl]ammonio]ethyl-methylsulfonyl-azanide CAS Name: 2-[[(1S)-1-(3,4-dimethylphenyl)ethyl]ammonio]ethyl-methylsulfonylazanide IUPAC Name: 2-[[(1S)-1-(3,4-dimethylphenyl)ethyl]azaniumyl]ethyl-methylsulfonylazanide Traditional Name: 2-[[(1S)-1-(3,4-dimethylphenyl)ethyl]ammonio]ethyl-mesyl-azanide Formula: C13H22N2O2S MolecularWeight: 270.39098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH2+]CC[N-]S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](C)[NH2+]CC[N-]S(=O)(=O)C)C

InChI

InChI=1S/C13H21N2O2S/c1-10-5-6-13(9-11(10)2)12(3)14-7-8-15-18(4,16)17/h5-6,9,12,14H,7-8H2,1-4H3/q-1/p+1/t12-/m0/s1