9-octylheptadecan-9-ylazanium methanoate

Systemtic Name: 9-octylheptadecan-9-ylazanium methanoate Openeye Name: 1,1-dioctylnonylammonium formate CAS Name: 9-octylheptadecan-9-ylammonium formate IUPAC Name: 9-octylheptadecan-9-ylazanium formate Traditional Name: 1,1-dioctylnonylammonium formate Formula: C26H55NO2 MolecularWeight: 413.7204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCCC)(CCCCCCCC)[NH3+].C(=O)[O-]

Isomeric SMILES

CCCCCCCCC(CCCCCCCC)(CCCCCCCC)[NH3+].C(=O)[O-]

InChI

InChI=1S/C25H53N.CH2O2/c1-4-7-10-13-16-19-22-25(26,23-20-17-14-11-8-5-2)24-21-18-15-12-9-6-3;2-1-3/h4-24,26H2,1-3H3;1H,(H,2,3)