3-hexadecylsulfanylpropoxy-oxidanyl-oxidanylidene-phosphanium; 2-oxidanylpropylazanium; hydroxide

Systemtic Name: 3-hexadecylsulfanylpropoxy-oxidanyl-oxidanylidene-phosphanium; 2-oxidanylpropylazanium; hydroxide Openeye Name: 3-hexadecylsulfanylpropoxy-hydroxy-oxo-phosphonium; 2-hydroxypropylammonium; hydroxide CAS Name: 3-(hexadecylthio)propoxy-hydroxy-oxophosphonium; 2-hydroxypropylammonium; hydroxide IUPAC Name: 3-hexadecylsulfanylpropoxy-hydroxy-oxophosphanium; 2-hydroxypropylazanium; hydroxide Traditional Name: 3-(cetylthio)propoxy-hydroxy-keto-phosphonium; 2-hydroxypropylammonium; hydroxide Formula: C22H51NO5PS+ MolecularWeight: 472.682801

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCCCO[P+](=O)O.CC(C[NH3+])O.[OH-]

Isomeric SMILES

CCCCCCCCCCCCCCCCSCCCO[P+](=O)O.CC(C[NH3+])O.[OH-]

InChI

InChI=1S/C19H39O3PS.C3H9NO.H2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-24-19-16-17-22-23(20)21;1-3(5)2-4;/h2-19H2,1H3;3,5H,2,4H2,1H3;1H2/p+1