sodium 1-methoxy-1-oxidanylidene-octadecane-9-sulfonic acid

Systemtic Name: sodium 1-methoxy-1-oxidanylidene-octadecane-9-sulfonic acid Openeye Name: sodium 1-methoxy-1-oxo-octadecane-9-sulfonic acid CAS Name: sodium 1-methoxy-1-oxo-9-octadecanesulfonic acid IUPAC Name: sodium 1-methoxy-1-oxooctadecane-9-sulfonic acid Traditional Name: sodium 1-keto-1-methoxy-octadecane-9-sulfonic acid Formula: C19H38NaO5S+ MolecularWeight: 401.55679

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCCCC(=O)OC)S(=O)(=O)O.[Na+]

Isomeric SMILES

CCCCCCCCCC(CCCCCCCC(=O)OC)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C19H38O5S.Na/c1-3-4-5-6-7-9-12-15-18(25(21,22)23)16-13-10-8-11-14-17-19(20)24-2;/h18H,3-17H2,1-2H3,(H,21,22,23);/q;+1