1-(3-hydroxyphenyl)propan-2-yl-prop-2-ynyl-azanium chloride

Systemtic Name: 1-(3-hydroxyphenyl)propan-2-yl-prop-2-ynyl-azanium chloride Openeye Name: [2-(3-hydroxyphenyl)-1-methyl-ethyl]-prop-2-ynyl-ammonium chloride CAS Name: 1-(3-hydroxyphenyl)propan-2-yl-prop-2-ynylammonium chloride IUPAC Name: 1-(3-hydroxyphenyl)propan-2-yl-prop-2-ynylazanium chloride Traditional Name: [2-(3-hydroxyphenyl)-1-methyl-ethyl]-propargyl-ammonium chloride Formula: C12H16ClNO MolecularWeight: 225.71454

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC=C1)O)[NH2+]CC#C.[Cl-]

Isomeric SMILES

CC(CC1=CC(=CC=C1)O)[NH2+]CC#C.[Cl-]

InChI

InChI=1S/C12H15NO.ClH/c1-3-7-13-10(2)8-11-5-4-6-12(14)9-11;/h1,4-6,9-10,13-14H,7-8H2,2H3;1H