hexadecyl-dimethyl-propyl-azanium sulfate

Systemtic Name: hexadecyl-dimethyl-propyl-azanium sulfate Openeye Name: hexadecyl-dimethyl-propyl-ammonium sulfate CAS Name: hexadecyl-dimethyl-propylammonium sulfate IUPAC Name: hexadecyl-dimethyl-propylazanium sulfate Traditional Name: cetyl-dimethyl-propyl-ammonium sulfate Formula: C21H46NO4S- MolecularWeight: 408.65924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCC.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCC.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C21H46N.H2O4S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-22(3,4)20-6-2;1-5(2,3)4/h5-21H2,1-4H3;(H2,1,2,3,4)/q+1;/p-2