heptadecan-2-ylazanium; methyl sulfate

Systemtic Name: heptadecan-2-ylazanium; methyl sulfate Openeye Name: 1-methylhexadecylammonium; methyl sulfate CAS Name: heptadecan-2-ylammonium; methyl sulfate IUPAC Name: heptadecan-2-ylazanium; methyl sulfate Traditional Name: 1-methylhexadecylammonium; methyl sulfate Formula: C18H41NO4S MolecularWeight: 367.58744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C)[NH3+].COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(C)[NH3+].COS(=O)(=O)[O-]

InChI

InChI=1S/C17H37N.CH4O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)18;1-5-6(2,3)4/h17H,3-16,18H2,1-2H3;1H3,(H,2,3,4)