2-hydroxyethyl-methyl-(2-oxidanyldodecyl)-(phenylmethyl)azanium chloride

Systemtic Name: 2-hydroxyethyl-methyl-(2-oxidanyldodecyl)-(phenylmethyl)azanium chloride Openeye Name: benzyl-(2-hydroxydodecyl)-(2-hydroxyethyl)-methyl-ammonium chloride CAS Name: 2-hydroxydodecyl-(2-hydroxyethyl)-methyl-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-(2-hydroxydodecyl)-(2-hydroxyethyl)-methylazanium chloride Traditional Name: benzyl-(2-hydroxydodecyl)-(2-hydroxyethyl)-methyl-ammonium chloride Formula: C22H40ClNO2 MolecularWeight: 386.0115

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C[N+](C)(CCO)CC1=CC=CC=C1)O.[Cl-]

Isomeric SMILES

CCCCCCCCCCC(C[N+](C)(CCO)CC1=CC=CC=C1)O.[Cl-]

InChI

InChI=1S/C22H40NO2.ClH/c1-3-4-5-6-7-8-9-13-16-22(25)20-23(2,17-18-24)19-21-14-11-10-12-15-21;/h10-12,14-15,22,24-25H,3-9,13,16-20H2,1-2H3;1H/q+1;/p-1