1-(4-methylsulfonylphenyl)propan-2-ylazanium chloride

Systemtic Name: 1-(4-methylsulfonylphenyl)propan-2-ylazanium chloride Openeye Name: [1-methyl-2-(4-methylsulfonylphenyl)ethyl]ammonium chloride CAS Name: 1-(4-methylsulfonylphenyl)propan-2-ylammonium chloride IUPAC Name: 1-(4-methylsulfonylphenyl)propan-2-ylazanium chloride Traditional Name: [2-(4-mesylphenyl)-1-methyl-ethyl]ammonium chloride Formula: C10H16ClNO2S MolecularWeight: 249.75754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)S(=O)(=O)C)[NH3+].[Cl-]

Isomeric SMILES

CC(CC1=CC=C(C=C1)S(=O)(=O)C)[NH3+].[Cl-]

InChI

InChI=1S/C10H15NO2S.ClH/c1-8(11)7-9-3-5-10(6-4-9)14(2,12)13;/h3-6,8H,7,11H2,1-2H3;1H