[1,5-bis(oxidanyl)-3-phenyl-pentan-3-yl]-dodecyl-azanium chloride

Systemtic Name: [1,5-bis(oxidanyl)-3-phenyl-pentan-3-yl]-dodecyl-azanium chloride Openeye Name: dodecyl-[3-hydroxy-1-(2-hydroxyethyl)-1-phenyl-propyl]ammonium chloride CAS Name: (1,5-dihydroxy-3-phenylpentan-3-yl)-dodecylammonium chloride IUPAC Name: (1,5-dihydroxy-3-phenylpentan-3-yl)-dodecylazanium chloride Traditional Name: [3-hydroxy-1-(2-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(CCO)(CCO)C1=CC=CC=C1.[Cl-]

Isomeric SMILES

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

InChI

InChI=1S/C23H41NO2.ClH/c1-2-3-4-5-6-7-8-9-10-14-19-24-23(17-20-25,18-21-26)22-15-12-11-13-16-22;/h11-13,15-16,24-26H,2-10,14,17-21H2,1H3;1H