(4-acetyloxy-4-methyl-pent-2-ynyl)-diethyl-azanium chloride

Systemtic Name: (4-acetyloxy-4-methyl-pent-2-ynyl)-diethyl-azanium chloride Openeye Name: (4-acetoxy-4-methyl-pent-2-ynyl)-diethyl-ammonium chloride CAS Name: (4-acetyloxy-4-methylpent-2-ynyl)-diethylammonium chloride IUPAC Name: (4-acetyloxy-4-methylpent-2-ynyl)-diethylazanium chloride Traditional Name: (4-acetoxy-4-methyl-pent-2-ynyl)-diethyl-ammonium chloride Formula: C12H22ClNO2 MolecularWeight: 247.76158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H21NO2.ClH/c1-6-13(7-2)10-8-9-12(4,5)15-11(3)14;/h6-7,10H2,1-5H3;1H