dodecyl-bis(2-hydroxyethyl)-(octylsulfanylmethyl)azanium chloride

Systemtic Name: dodecyl-bis(2-hydroxyethyl)-(octylsulfanylmethyl)azanium chloride Openeye Name: dodecyl-bis(2-hydroxyethyl)-(octylsulfanylmethyl)ammonium chloride CAS Name: dodecyl-bis(2-hydroxyethyl)-[(octylthio)methyl]ammonium chloride IUPAC Name: dodecyl-bis(2-hydroxyethyl)-(octylsulfanylmethyl)azanium chloride Traditional Name: bis(2-hydroxyethyl)-lauryl-[(octylthio)methyl]ammonium chloride Formula: C25H54ClNO2S MolecularWeight: 468.21976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](CCO)(CCO)CSCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCC[N+](CCO)(CCO)CSCCCCCCCC.[Cl-]

InChI

InChI=1S/C25H54NO2S.ClH/c1-3-5-7-9-11-12-13-14-15-17-19-26(20-22-27,21-23-28)25-29-24-18-16-10-8-6-4-2;/h27-28H,3-25H2,1-2H3;1H/q+1;/p-1