[(2S)-3,3-dimethyl-1-oxidanylidene-1-phenyl-butan-2-yl]azanium chloride

Systemtic Name: [(2S)-3,3-dimethyl-1-oxidanylidene-1-phenyl-butan-2-yl]azanium chloride Openeye Name: [(1S)-1-benzoyl-2,2-dimethyl-propyl]ammonium chloride CAS Name: [(2S)-3,3-dimethyl-1-oxo-1-phenylbutan-2-yl]ammonium chloride IUPAC Name: [(2S)-3,3-dimethyl-1-oxo-1-phenylbutan-2-yl]azanium chloride Traditional Name: [(1S)-1-benzoyl-2,2-dimethyl-propyl]ammonium chloride Formula: C12H18ClNO MolecularWeight: 227.73042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)C1=CC=CC=C1)[NH3+].[Cl-]

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)C1=CC=CC=C1)[NH3+].[Cl-]

InChI

InChI=1S/C12H17NO.ClH/c1-12(2,3)11(13)10(14)9-7-5-4-6-8-9;/h4-8,11H,13H2,1-3H3;1H/t11-;/m1./s1