ethyl sulfate; 2-methylhenicosan-2-ylazanium

Systemtic Name: ethyl sulfate; 2-methylhenicosan-2-ylazanium Openeye Name: 1,1-dimethylicosylammonium; ethyl sulfate CAS Name: ethyl sulfate; 2-methylheneicosan-2-ylammonium IUPAC Name: ethyl sulfate; 2-methylhenicosan-2-ylazanium Traditional Name: 1,1-dimethyleicosylammonium; ethyl sulfate Formula: C24H53NO4S MolecularWeight: 451.74692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(C)(C)[NH3+].CCOS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(C)(C)[NH3+].CCOS(=O)(=O)[O-]

InChI

InChI=1S/C22H47N.C2H6O4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(2,3)23;1-2-6-7(3,4)5/h4-21,23H2,1-3H3;2H2,1H3,(H,3,4,5)