[2,4-bis(oxidanyl)-3-phenyl-pentan-3-yl]-dodecyl-azanium chloride

Systemtic Name: [2,4-bis(oxidanyl)-3-phenyl-pentan-3-yl]-dodecyl-azanium chloride Openeye Name: dodecyl-[2-hydroxy-1-(1-hydroxyethyl)-1-phenyl-propyl]ammonium chloride CAS Name: (2,4-dihydroxy-3-phenylpentan-3-yl)-dodecylammonium chloride IUPAC Name: (2,4-dihydroxy-3-phenylpentan-3-yl)-dodecylazanium chloride Traditional Name: [2-hydroxy-1-(1-hydroxyethyl)-1-phenyl-propyl]-lauryl-ammonium chloride Formula: C23H42ClNO2 MolecularWeight: 400.03808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[NH2+]C(C1=CC=CC=C1)(C(C)O)C(C)O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCC[NH2+]C(C1=CC=CC=C1)(C(C)O)C(C)O.[Cl-]

InChI

InChI=1S/C23H41NO2.ClH/c1-4-5-6-7-8-9-10-11-12-16-19-24-23(20(2)25,21(3)26)22-17-14-13-15-18-22;/h13-15,17-18,20-21,24-26H,4-12,16,19H2,1-3H3;1H