(2-ethoxy-3-hexadecylsulfanyl-propyl)-(2-hydroxyethyl)-dimethyl-azanium

Systemtic Name: (2-ethoxy-3-hexadecylsulfanyl-propyl)-(2-hydroxyethyl)-dimethyl-azanium Openeye Name: (2-ethoxy-3-hexadecylsulfanyl-propyl)-(2-hydroxyethyl)-dimethyl-ammonium CAS Name: [2-ethoxy-3-(hexadecylthio)propyl]-(2-hydroxyethyl)-dimethylammonium IUPAC Name: (2-ethoxy-3-hexadecylsulfanylpropyl)-(2-hydroxyethyl)-dimethylazanium Traditional Name: [3-(cetylthio)-2-ethoxy-propyl]-(2-hydroxyethyl)-dimethyl-ammonium Formula: C25H54NO2S+ MolecularWeight: 432.76676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC(C[N+](C)(C)CCO)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC(C[N+](C)(C)CCO)OCC

InChI

InChI=1S/C25H54NO2S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-22-29-24-25(28-6-2)23-26(3,4)20-21-27/h25,27H,5-24H2,1-4H3/q+1