methyl(octyl)azanium; octane; methanoate

Systemtic Name: methyl(octyl)azanium; octane; methanoate Openeye Name: methyl(octyl)ammonium; octane; formate CAS Name: methyl(octyl)ammonium; octane; formate IUPAC Name: methyl(octyl)azanium; octane; formate Traditional Name: methyl(octyl)ammonium; n-octane; formate Formula: C26H59NO2 MolecularWeight: 417.75216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC.CCCCCCCC.CCCCCCCC[NH2+]C.C(=O)[O-]

Isomeric SMILES

CCCCCCCC.CCCCCCCC.CCCCCCCC[NH2+]C.C(=O)[O-]

InChI

InChI=1S/C9H21N.2C8H18.CH2O2/c1-3-4-5-6-7-8-9-10-2;2*1-3-5-7-8-6-4-2;2-1-3/h10H,3-9H2,1-2H3;2*3-8H2,1-2H3;1H,(H,2,3)