3-(2-sulfanyloctylamino)propane-1-sulfonic acid

Systemtic Name: 3-(2-sulfanyloctylamino)propane-1-sulfonic acid Openeye Name: 3-(2-sulfanyloctylamino)propane-1-sulfonic acid CAS Name: 3-(2-mercaptooctylamino)-1-propanesulfonic acid IUPAC Name: 3-(2-sulfanyloctylamino)propane-1-sulfonic acid Traditional Name: 3-(2-mercaptooctylamino)propane-1-sulfonic acid Formula: C11H25NO3S2 MolecularWeight: 283.4511

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CNCCCS(=O)(=O)O)S

Isomeric SMILES

CCCCCCC(CNCCCS(=O)(=O)O)S

InChI

InChI=1S/C11H25NO3S2/c1-2-3-4-5-7-11(16)10-12-8-6-9-17(13,14)15/h11-12,16H,2-10H2,1H3,(H,13,14,15)