(3-dodecoxy-2-oxidanyl-propyl)-bis(2-hydroxyethyl)-methyl-azanium; methyl sulfate

Systemtic Name: (3-dodecoxy-2-oxidanyl-propyl)-bis(2-hydroxyethyl)-methyl-azanium; methyl sulfate Openeye Name: (3-dodecoxy-2-hydroxy-propyl)-bis(2-hydroxyethyl)-methyl-ammonium; methyl sulfate CAS Name: (3-dodecoxy-2-hydroxypropyl)-bis(2-hydroxyethyl)-methylammonium; methyl sulfate IUPAC Name: (3-dodecoxy-2-hydroxypropyl)-bis(2-hydroxyethyl)-methylazanium; methyl sulfate Traditional Name: bis(2-hydroxyethyl)-(2-hydroxy-3-lauryloxy-propyl)-methyl-ammonium; methyl sulfate Formula: C21H47NO8S MolecularWeight: 473.66478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCC(C[N+](C)(CCO)CCO)O.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCOCC(C[N+](C)(CCO)CCO)O.COS(=O)(=O)[O-]

InChI

InChI=1S/C20H44NO4.CH4O4S/c1-3-4-5-6-7-8-9-10-11-12-17-25-19-20(24)18-21(2,13-15-22)14-16-23;1-5-6(2,3)4/h20,22-24H,3-19H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1