[1-(2,6-dimethylphenoxy)-1-oxidanylidene-butan-2-yl]-diethyl-azanium chloride

Systemtic Name: [1-(2,6-dimethylphenoxy)-1-oxidanylidene-butan-2-yl]-diethyl-azanium chloride Openeye Name: 1-(2,6-dimethylphenoxy)carbonylpropyl-diethyl-ammonium chloride CAS Name: [1-(2,6-dimethylphenoxy)-1-oxobutan-2-yl]-diethylammonium chloride IUPAC Name: [1-(2,6-dimethylphenoxy)-1-oxobutan-2-yl]-diethylazanium chloride Traditional Name: 1-(2,6-dimethylphenoxy)carbonylpropyl-diethyl-ammonium chloride Formula: C16H26ClNO2 MolecularWeight: 299.83614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1=C(C=CC=C1C)C)[NH+](CC)CC.[Cl-]

Isomeric SMILES

CCC(C(=O)OC1=C(C=CC=C1C)C)[NH+](CC)CC.[Cl-]

InChI

InChI=1S/C16H25NO2.ClH/c1-6-14(17(7-2)8-3)16(18)19-15-12(4)10-9-11-13(15)5;/h9-11,14H,6-8H2,1-5H3;1H