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

Systemtic Name: [2-(hydroxymethyl)-1-oxidanyl-4-(4-tridecylphenyl)butan-2-yl]azanium chloride Openeye Name: [1,1-bis(hydroxymethyl)-3-(4-tridecylphenyl)propyl]ammonium chloride CAS Name: [1-hydroxy-2-(hydroxymethyl)-4-(4-tridecylphenyl)butan-2-yl]ammonium chloride IUPAC Name: [1-hydroxy-2-(hydroxymethyl)-4-(4-tridecylphenyl)butan-2-yl]azanium chloride Traditional Name: [1,1-dimethylol-3-(4-tridecylphenyl)propyl]ammonium chloride Formula: C24H44ClNO2 MolecularWeight: 414.06466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

InChI

InChI=1S/C24H43NO2.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-22-14-16-23(17-15-22)18-19-24(25,20-26)21-27;/h14-17,26-27H,2-13,18-21,25H2,1H3;1H