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

Systemtic Name: [4-(4-heptylphenyl)-2-(hydroxymethyl)-1-oxidanyl-butan-2-yl]azanium chloride Openeye Name: [3-(4-heptylphenyl)-1,1-bis(hydroxymethyl)propyl]ammonium chloride CAS Name: [4-(4-heptylphenyl)-1-hydroxy-2-(hydroxymethyl)butan-2-yl]ammonium chloride IUPAC Name: [4-(4-heptylphenyl)-1-hydroxy-2-(hydroxymethyl)butan-2-yl]azanium chloride Traditional Name: [3-(4-heptylphenyl)-1,1-dimethylol-propyl]ammonium chloride Formula: C18H32ClNO2 MolecularWeight: 329.90518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

InChI

InChI=1S/C18H31NO2.ClH/c1-2-3-4-5-6-7-16-8-10-17(11-9-16)12-13-18(19,14-20)15-21;/h8-11,20-21H,2-7,12-15,19H2,1H3;1H