dimethyl-bis(2-oxidanyltetradecyl)azanium; methyl sulfate

Systemtic Name: dimethyl-bis(2-oxidanyltetradecyl)azanium; methyl sulfate Openeye Name: bis(2-hydroxytetradecyl)-dimethyl-ammonium; methyl sulfate CAS Name: bis(2-hydroxytetradecyl)-dimethylammonium; methyl sulfate IUPAC Name: bis(2-hydroxytetradecyl)-dimethylazanium; methyl sulfate Traditional Name: bis(2-hydroxytetradecyl)-dimethyl-ammonium; methyl sulfate Formula: C31H67NO6S MolecularWeight: 581.93178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H64NO2.CH4O4S/c1-5-7-9-11-13-15-17-19-21-23-25-29(32)27-31(3,4)28-30(33)26-24-22-20-18-16-14-12-10-8-6-2;1-5-6(2,3)4/h29-30,32-33H,5-28H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1