1-oxidanylbutan-2-yl-(3-oxidanylidene-3-phenyl-propyl)azanium chloride

Systemtic Name: 1-oxidanylbutan-2-yl-(3-oxidanylidene-3-phenyl-propyl)azanium chloride Openeye Name: 1-(hydroxymethyl)propyl-(3-oxo-3-phenyl-propyl)ammonium chloride CAS Name: 1-hydroxybutan-2-yl-(3-oxo-3-phenylpropyl)ammonium chloride IUPAC Name: 1-hydroxybutan-2-yl-(3-oxo-3-phenylpropyl)azanium chloride Traditional Name: (3-keto-3-phenyl-propyl)-(1-methylolpropyl)ammonium chloride Formula: C13H20ClNO2 MolecularWeight: 257.7564

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]CCC(=O)C1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCC(CO)[NH2+]CCC(=O)C1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C13H19NO2.ClH/c1-2-12(10-15)14-9-8-13(16)11-6-4-3-5-7-11;/h3-7,12,14-15H,2,8-10H2,1H3;1H