3-(hexylcarbamoylamino)propane-1-sulfonic acid

Systemtic Name: 3-(hexylcarbamoylamino)propane-1-sulfonic acid Openeye Name: 3-(hexylcarbamoylamino)propane-1-sulfonic acid CAS Name: 3-[[(hexylamino)-oxomethyl]amino]-1-propanesulfonic acid IUPAC Name: 3-(hexylcarbamoylamino)propane-1-sulfonic acid Traditional Name: 3-(hexylcarbamoylamino)propane-1-sulfonic acid Formula: C10H22N2O4S MolecularWeight: 266.35768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)NCCCS(=O)(=O)O

Isomeric SMILES

CCCCCCNC(=O)NCCCS(=O)(=O)O

InChI

InChI=1S/C10H22N2O4S/c1-2-3-4-5-7-11-10(13)12-8-6-9-17(14,15)16/h2-9H2,1H3,(H2,11,12,13)(H,14,15,16)