sodium 1-azanyl-3-oxidanylidene-octadecane-2-sulfonic acid

Systemtic Name: sodium 1-azanyl-3-oxidanylidene-octadecane-2-sulfonic acid Openeye Name: sodium 1-amino-3-oxo-octadecane-2-sulfonic acid CAS Name: sodium 1-amino-3-oxo-2-octadecanesulfonic acid IUPAC Name: sodium 1-amino-3-oxooctadecane-2-sulfonic acid Traditional Name: sodium 1-amino-3-keto-octadecane-2-sulfonic acid Formula: C18H37NNaO4S+ MolecularWeight: 386.54545

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(CN)S(=O)(=O)O.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(CN)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C18H37NO4S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(20)18(16-19)24(21,22)23;/h18H,2-16,19H2,1H3,(H,21,22,23);/q;+1