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

Systemtic Name: [2-(hydroxymethyl)-1-oxidanyl-4-(4-tetradecylphenyl)butan-2-yl]azanium chloride Openeye Name: [1,1-bis(hydroxymethyl)-3-(4-tetradecylphenyl)propyl]ammonium chloride CAS Name: [1-hydroxy-2-(hydroxymethyl)-4-(4-tetradecylphenyl)butan-2-yl]ammonium chloride IUPAC Name: [1-hydroxy-2-(hydroxymethyl)-4-(4-tetradecylphenyl)butan-2-yl]azanium chloride Traditional Name: [1,1-dimethylol-3-(4-myristylphenyl)propyl]ammonium chloride Formula: C25H46ClNO2 MolecularWeight: 428.09124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

InChI

InChI=1S/C25H45NO2.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-23-15-17-24(18-16-23)19-20-25(26,21-27)22-28;/h15-18,27-28H,2-14,19-22,26H2,1H3;1H