azanium 2-(2-methyloctyl)benzenesulfonate

Systemtic Name: azanium 2-(2-methyloctyl)benzenesulfonate Openeye Name: ammonium 2-(2-methyloctyl)benzenesulfonate CAS Name: ammonium 2-(2-methyloctyl)benzenesulfonate IUPAC Name: azanium 2-(2-methyloctyl)benzenesulfonate Traditional Name: ammonium 2-(2-methyloctyl)besylate Formula: C15H27NO3S MolecularWeight: 301.44478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)CC1=CC=CC=C1S(=O)(=O)[O-].[NH4+]

Isomeric SMILES

CCCCCCC(C)CC1=CC=CC=C1S(=O)(=O)[O-].[NH4+]

InChI

InChI=1S/C15H24O3S.H3N/c1-3-4-5-6-9-13(2)12-14-10-7-8-11-15(14)19(16,17)18;/h7-8,10-11,13H,3-6,9,12H2,1-2H3,(H,16,17,18);1H3