[2-[(2S)-3-methyl-1-oxidanylidene-1-phenyl-butan-2-yl]oxy-2-oxidanylidene-ethyl]azanium chloride

Systemtic Name: [2-[(2S)-3-methyl-1-oxidanylidene-1-phenyl-butan-2-yl]oxy-2-oxidanylidene-ethyl]azanium chloride Openeye Name: [2-[(1S)-1-benzoyl-2-methyl-propoxy]-2-oxo-ethyl]ammonium chloride CAS Name: [2-[(2S)-3-methyl-1-oxo-1-phenylbutan-2-yl]oxy-2-oxoethyl]ammonium chloride IUPAC Name: [2-[(2S)-3-methyl-1-oxo-1-phenylbutan-2-yl]oxy-2-oxoethyl]azanium chloride Traditional Name: [2-[(1S)-1-benzoyl-2-methyl-propoxy]-2-keto-ethyl]ammonium chloride Formula: C13H18ClNO3 MolecularWeight: 271.73992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3.ClH/c1-9(2)13(17-11(15)8-14)12(16)10-6-4-3-5-7-10;/h3-7,9,13H,8,14H2,1-2H3;1H/t13-;/m0./s1