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

Systemtic Name: (2-ethoxy-3-hexadecylsulfanyl-propyl)-dimethyl-(3-oxidanylpropyl)azanium Openeye Name: (2-ethoxy-3-hexadecylsulfanyl-propyl)-(3-hydroxypropyl)-dimethyl-ammonium CAS Name: [2-ethoxy-3-(hexadecylthio)propyl]-(3-hydroxypropyl)-dimethylammonium IUPAC Name: (2-ethoxy-3-hexadecylsulfanylpropyl)-(3-hydroxypropyl)-dimethylazanium Traditional Name: [3-(cetylthio)-2-ethoxy-propyl]-(3-hydroxypropyl)-dimethyl-ammonium Formula: C26H56NO2S+ MolecularWeight: 446.79334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H56NO2S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-23-30-25-26(29-6-2)24-27(3,4)21-20-22-28/h26,28H,5-25H2,1-4H3/q+1