methyl-[(2R)-1-phenylpropan-2-yl]-prop-2-ynyl-azanium chloride

Systemtic Name: methyl-[(2R)-1-phenylpropan-2-yl]-prop-2-ynyl-azanium chloride Openeye Name: methyl-[(1R)-1-methyl-2-phenyl-ethyl]-prop-2-ynyl-ammonium chloride CAS Name: methyl-[(2R)-1-phenylpropan-2-yl]-prop-2-ynylammonium chloride IUPAC Name: methyl-[(2R)-1-phenylpropan-2-yl]-prop-2-ynylazanium chloride Traditional Name: methyl-[(1R)-1-methyl-2-phenyl-ethyl]-propargyl-ammonium chloride Formula: C13H18ClN MolecularWeight: 223.74172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](CC1=CC=CC=C1)[NH+](C)CC#C.[Cl-]

InChI

InChI=1S/C13H17N.ClH/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13;/h1,5-9,12H,10-11H2,2-3H3;1H/t12-;/m1./s1