tert-butyl-[(2S)-1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl]azanium chloride

Systemtic Name: tert-butyl-[(2S)-1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl]azanium chloride Openeye Name: tert-butyl-[(1S)-2-(3-chlorophenyl)-1-methyl-2-oxo-ethyl]ammonium chloride CAS Name: tert-butyl-[(2S)-1-(3-chlorophenyl)-1-oxopropan-2-yl]ammonium chloride IUPAC Name: tert-butyl-[(2S)-1-(3-chlorophenyl)-1-oxopropan-2-yl]azanium chloride Traditional Name: tert-butyl-[(1S)-2-(3-chlorophenyl)-2-keto-1-methyl-ethyl]ammonium chloride Formula: C13H19Cl2NO MolecularWeight: 276.20206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)C1=CC(=CC=C1)Cl)[NH2+]C(C)(C)C.[Cl-]

InChI

InChI=1S/C13H18ClNO.ClH/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10;/h5-9,15H,1-4H3;1H/t9-;/m0./s1