2-methyltridecan-2-ylazanium ethanoate

Systemtic Name: 2-methyltridecan-2-ylazanium ethanoate Openeye Name: 1,1-dimethyldodecylammonium acetate CAS Name: 2-methyltridecan-2-ylammonium acetate IUPAC Name: 2-methyltridecan-2-ylazanium acetate Traditional Name: 1,1-dimethyldodecylammonium acetate Formula: C16H35NO2 MolecularWeight: 273.4546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C)(C)[NH3+].CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(C)(C)[NH3+].CC(=O)[O-]

InChI

InChI=1S/C14H31N.C2H4O2/c1-4-5-6-7-8-9-10-11-12-13-14(2,3)15;1-2(3)4/h4-13,15H2,1-3H3;1H3,(H,3,4)