henicosyl-dimethyl-(2-oxidanyl-3-sulfo-propyl)azanium

Systemtic Name: henicosyl-dimethyl-(2-oxidanyl-3-sulfo-propyl)azanium Openeye Name: henicosyl-(2-hydroxy-3-sulfo-propyl)-dimethyl-ammonium CAS Name: heneicosyl-(2-hydroxy-3-sulfopropyl)-dimethylammonium IUPAC Name: henicosyl-(2-hydroxy-3-sulfopropyl)-dimethylazanium Traditional Name: heneicosyl-(2-hydroxy-3-sulfo-propyl)-dimethyl-ammonium Formula: C26H56NO4S+ MolecularWeight: 478.79214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC(CS(=O)(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC(CS(=O)(=O)O)O

InChI

InChI=1S/C26H55NO4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27(2,3)24-26(28)25-32(29,30)31/h26,28H,4-25H2,1-3H3/p+1