dimethyl-[3-oxidanyl-2-phenyl-3-(2,4,6-trimethylphenyl)propyl]azanium chloride

Systemtic Name: dimethyl-[3-oxidanyl-2-phenyl-3-(2,4,6-trimethylphenyl)propyl]azanium chloride Openeye Name: [3-hydroxy-2-phenyl-3-(2,4,6-trimethylphenyl)propyl]-dimethyl-ammonium chloride CAS Name: [3-hydroxy-2-phenyl-3-(2,4,6-trimethylphenyl)propyl]-dimethylammonium chloride IUPAC Name: [3-hydroxy-2-phenyl-3-(2,4,6-trimethylphenyl)propyl]-dimethylazanium chloride Traditional Name: (3-hydroxy-3-mesityl-2-phenyl-propyl)-dimethyl-ammonium chloride Formula: C20H28ClNO MolecularWeight: 333.89542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(C(C[NH+](C)C)C2=CC=CC=C2)O)C.[Cl-]

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(C(C[NH+](C)C)C2=CC=CC=C2)O)C.[Cl-]

InChI

InChI=1S/C20H27NO.ClH/c1-14-11-15(2)19(16(3)12-14)20(22)18(13-21(4)5)17-9-7-6-8-10-17;/h6-12,18,20,22H,13H2,1-5H3;1H