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

Systemtic Name: [2-(hydroxymethyl)-4-(4-octylphenyl)-1-oxidanyl-butan-2-yl]azanium chloride Openeye Name: [1,1-bis(hydroxymethyl)-3-(4-octylphenyl)propyl]ammonium chloride CAS Name: [1-hydroxy-2-(hydroxymethyl)-4-(4-octylphenyl)butan-2-yl]ammonium chloride IUPAC Name: [1-hydroxy-2-(hydroxymethyl)-4-(4-octylphenyl)butan-2-yl]azanium chloride Traditional Name: [1,1-dimethylol-3-(4-octylphenyl)propyl]ammonium chloride Formula: C19H34ClNO2 MolecularWeight: 343.93176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

InChI

InChI=1S/C19H33NO2.ClH/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20,15-21)16-22;/h9-12,21-22H,2-8,13-16,20H2,1H3;1H