ethyl(tridecan-2-yl)azanium; methyl sulfate

Systemtic Name: ethyl(tridecan-2-yl)azanium; methyl sulfate Openeye Name: ethyl(1-methyldodecyl)ammonium; methyl sulfate CAS Name: ethyl(tridecan-2-yl)ammonium; methyl sulfate IUPAC Name: ethyl(tridecan-2-yl)azanium; methyl sulfate Traditional Name: ethyl(1-methyldodecyl)ammonium; methyl sulfate Formula: C16H37NO4S MolecularWeight: 339.53428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C)[NH2+]CC.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(C)[NH2+]CC.COS(=O)(=O)[O-]

InChI

InChI=1S/C15H33N.CH4O4S/c1-4-6-7-8-9-10-11-12-13-14-15(3)16-5-2;1-5-6(2,3)4/h15-16H,4-14H2,1-3H3;1H3,(H,2,3,4)