dimethyl-(5-oxidanylidene-4,4-diphenyl-heptyl)azanium chloride

Systemtic Name: dimethyl-(5-oxidanylidene-4,4-diphenyl-heptyl)azanium chloride Openeye Name: dimethyl-(5-oxo-4,4-diphenyl-heptyl)ammonium chloride CAS Name: dimethyl-(5-oxo-4,4-diphenylheptyl)ammonium chloride IUPAC Name: dimethyl-(5-oxo-4,4-diphenylheptyl)azanium chloride Traditional Name: (5-keto-4,4-diphenyl-heptyl)-dimethyl-ammonium chloride Formula: C21H28ClNO MolecularWeight: 345.90612

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCC[NH+](C)C)(C1=CC=CC=C1)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCC(=O)C(CCC[NH+](C)C)(C1=CC=CC=C1)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C21H27NO.ClH/c1-4-20(23)21(16-11-17-22(2)3,18-12-7-5-8-13-18)19-14-9-6-10-15-19;/h5-10,12-15H,4,11,16-17H2,1-3H3;1H