(6-methoxy-2-methyl-6,6-diphenyl-hex-4-yn-3-yl)-dimethyl-azanium chloride

Systemtic Name: (6-methoxy-2-methyl-6,6-diphenyl-hex-4-yn-3-yl)-dimethyl-azanium chloride Openeye Name: (1-isopropyl-4-methoxy-4,4-diphenyl-but-2-ynyl)-dimethyl-ammonium chloride CAS Name: (6-methoxy-2-methyl-6,6-diphenylhex-4-yn-3-yl)-dimethylammonium chloride IUPAC Name: (6-methoxy-2-methyl-6,6-diphenylhex-4-yn-3-yl)-dimethylazanium chloride Traditional Name: (1-isopropyl-4-methoxy-4,4-diphenyl-but-2-ynyl)-dimethyl-ammonium chloride Formula: C22H28ClNO MolecularWeight: 357.91682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#CC(C1=CC=CC=C1)(C2=CC=CC=C2)OC)[NH+](C)C.[Cl-]

Isomeric SMILES

CC(C)C(C#CC(C1=CC=CC=C1)(C2=CC=CC=C2)OC)[NH+](C)C.[Cl-]

InChI

InChI=1S/C22H27NO.ClH/c1-18(2)21(23(3)4)16-17-22(24-5,19-12-8-6-9-13-19)20-14-10-7-11-15-20;/h6-15,18,21H,1-5H3;1H