(4-ethoxy-2-methyl-4-oxidanylidene-3,3-diphenyl-butyl)-dimethyl-azanium chloride

Systemtic Name: (4-ethoxy-2-methyl-4-oxidanylidene-3,3-diphenyl-butyl)-dimethyl-azanium chloride Openeye Name: (4-ethoxy-2-methyl-4-oxo-3,3-diphenyl-butyl)-dimethyl-ammonium chloride CAS Name: (4-ethoxy-2-methyl-4-oxo-3,3-diphenylbutyl)-dimethylammonium chloride IUPAC Name: (4-ethoxy-2-methyl-4-oxo-3,3-diphenylbutyl)-dimethylazanium chloride Traditional Name: (4-ethoxy-4-keto-2-methyl-3,3-diphenyl-butyl)-dimethyl-ammonium chloride Formula: C21H28ClNO2 MolecularWeight: 361.90552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO2.ClH/c1-5-24-20(23)21(17(2)16-22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19;/h6-15,17H,5,16H2,1-4H3;1H