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

Systemtic Name: [4-(4-decylphenyl)-2-(hydroxymethyl)-1-oxidanyl-butan-2-yl]azanium chloride Openeye Name: [3-(4-decylphenyl)-1,1-bis(hydroxymethyl)propyl]ammonium chloride CAS Name: [4-(4-decylphenyl)-1-hydroxy-2-(hydroxymethyl)butan-2-yl]ammonium chloride IUPAC Name: [4-(4-decylphenyl)-1-hydroxy-2-(hydroxymethyl)butan-2-yl]azanium chloride Traditional Name: [3-(4-decylphenyl)-1,1-dimethylol-propyl]ammonium chloride Formula: C21H38ClNO2 MolecularWeight: 371.98492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)[NH3+].[Cl-]

InChI

InChI=1S/C21H37NO2.ClH/c1-2-3-4-5-6-7-8-9-10-19-11-13-20(14-12-19)15-16-21(22,17-23)18-24;/h11-14,23-24H,2-10,15-18,22H2,1H3;1H