methyl-(1-oxidanyl-1-phenyl-propan-2-yl)-prop-2-ynyl-azanium chloride

Systemtic Name: methyl-(1-oxidanyl-1-phenyl-propan-2-yl)-prop-2-ynyl-azanium chloride Openeye Name: (2-hydroxy-1-methyl-2-phenyl-ethyl)-methyl-prop-2-ynyl-ammonium chloride CAS Name: (1-hydroxy-1-phenylpropan-2-yl)-methyl-prop-2-ynylammonium chloride IUPAC Name: (1-hydroxy-1-phenylpropan-2-yl)-methyl-prop-2-ynylazanium chloride Traditional Name: (2-hydroxy-1-methyl-2-phenyl-ethyl)-methyl-propargyl-ammonium chloride Formula: C13H18ClNO MolecularWeight: 239.74112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)[NH+](C)CC#C.[Cl-]

Isomeric SMILES

CC(C(C1=CC=CC=C1)O)[NH+](C)CC#C.[Cl-]

InChI

InChI=1S/C13H17NO.ClH/c1-4-10-14(3)11(2)13(15)12-8-6-5-7-9-12;/h1,5-9,11,13,15H,10H2,2-3H3;1H