hexadecyl(dimethyl)azanium phosphate

Systemtic Name: hexadecyl(dimethyl)azanium phosphate Openeye Name: hexadecyl(dimethyl)ammonium phosphate CAS Name: hexadecyl(dimethyl)ammonium phosphate IUPAC Name: hexadecyl(dimethyl)azanium phosphate Traditional Name: cetyl(dimethyl)ammonium phosphate Formula: C54H120N3O4P MolecularWeight: 906.522061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[NH+](C)C.CCCCCCCCCCCCCCCC[NH+](C)C.CCCCCCCCCCCCCCCC[NH+](C)C.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[NH+](C)C.CCCCCCCCCCCCCCCC[NH+](C)C.CCCCCCCCCCCCCCCC[NH+](C)C.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/3C18H39N.H3O4P/c3*1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(2)3;1-5(2,3)4/h3*4-18H2,1-3H3;(H3,1,2,3,4)