2,3-dimethylnonan-2-ylazanium; octadecyl phosphate

Systemtic Name: 2,3-dimethylnonan-2-ylazanium; octadecyl phosphate Openeye Name: octadecyl phosphate; 1,1,2-trimethyloctylammonium CAS Name: 2,3-dimethylnonan-2-ylammonium; octadecyl phosphate IUPAC Name: 2,3-dimethylnonan-2-ylazanium; octadecyl phosphate Traditional Name: stearyl phosphate; 1,1,2-trimethyloctylammonium Formula: C29H63NO4P- MolecularWeight: 520.788581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOP(=O)([O-])[O-].CCCCCCC(C)C(C)(C)[NH3+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOP(=O)([O-])[O-].CCCCCCC(C)C(C)(C)[NH3+]

InChI

InChI=1S/C18H39O4P.C11H25N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-23(19,20)21;1-5-6-7-8-9-10(2)11(3,4)12/h2-18H2,1H3,(H2,19,20,21);10H,5-9,12H2,1-4H3/p-1