[4-(4-dodecylphenyl)-2-(hydroxymethyl)-1-oxidanyl-butan-2-yl]azanium chloride

Systemtic Name: [4-(4-dodecylphenyl)-2-(hydroxymethyl)-1-oxidanyl-butan-2-yl]azanium chloride Openeye Name: [3-(4-dodecylphenyl)-1,1-bis(hydroxymethyl)propyl]ammonium chloride CAS Name: [4-(4-dodecylphenyl)-1-hydroxy-2-(hydroxymethyl)butan-2-yl]ammonium chloride IUPAC Name: [4-(4-dodecylphenyl)-1-hydroxy-2-(hydroxymethyl)butan-2-yl]azanium chloride Traditional Name: [3-(4-laurylphenyl)-1,1-dimethylol-propyl]ammonium chloride Formula: C23H42ClNO2 MolecularWeight: 400.03808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

InChI

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