2-methyl-2-(undecanethioylamino)propane-1-sulfonic acid

Systemtic Name: 2-methyl-2-(undecanethioylamino)propane-1-sulfonic acid Openeye Name: 2-methyl-2-(undecanethioylamino)propane-1-sulfonic acid CAS Name: 2-methyl-2-(1-sulfanylideneundecylamino)-1-propanesulfonic acid IUPAC Name: 2-methyl-2-(undecanethioylamino)propane-1-sulfonic acid Traditional Name: 2-methyl-2-(undecanethioylamino)propane-1-sulfonic acid Formula: C15H31NO3S2 MolecularWeight: 337.54154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=S)NC(C)(C)CS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCC(=S)NC(C)(C)CS(=O)(=O)O

InChI

InChI=1S/C15H31NO3S2/c1-4-5-6-7-8-9-10-11-12-14(20)16-15(2,3)13-21(17,18)19/h4-13H2,1-3H3,(H,16,20)(H,17,18,19)