sodium 2-propan-2-yloxyhexadecane-1-sulfonic acid

Systemtic Name: sodium 2-propan-2-yloxyhexadecane-1-sulfonic acid Openeye Name: sodium 2-isopropoxyhexadecane-1-sulfonic acid CAS Name: sodium 2-propan-2-yloxy-1-hexadecanesulfonic acid IUPAC Name: sodium 2-propan-2-yloxyhexadecane-1-sulfonic acid Traditional Name: sodium 2-isopropoxyhexadecane-1-sulfonic acid Formula: C19H40NaO4S+ MolecularWeight: 387.57327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CS(=O)(=O)O)OC(C)C.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCC(CS(=O)(=O)O)OC(C)C.[Na+]

InChI

InChI=1S/C19H40O4S.Na/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19(23-18(2)3)17-24(20,21)22;/h18-19H,4-17H2,1-3H3,(H,20,21,22);/q;+1