(4-methyl-3-oxidanylidene-1-phenyl-pentan-2-yl)azanium chloride

Systemtic Name: (4-methyl-3-oxidanylidene-1-phenyl-pentan-2-yl)azanium chloride Openeye Name: (1-benzyl-3-methyl-2-oxo-butyl)ammonium chloride CAS Name: (4-methyl-3-oxo-1-phenylpentan-2-yl)ammonium chloride IUPAC Name: (4-methyl-3-oxo-1-phenylpentan-2-yl)azanium chloride Traditional Name: (1-benzyl-2-keto-3-methyl-butyl)ammonium chloride Formula: C12H18ClNO MolecularWeight: 227.73042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(CC1=CC=CC=C1)[NH3+].[Cl-]

Isomeric SMILES

CC(C)C(=O)C(CC1=CC=CC=C1)[NH3+].[Cl-]

InChI

InChI=1S/C12H17NO.ClH/c1-9(2)12(14)11(13)8-10-6-4-3-5-7-10;/h3-7,9,11H,8,13H2,1-2H3;1H