3-(2,6-dimethylphenoxy)-1-methyl-piperidin-1-ium chloride

Systemtic Name: 3-(2,6-dimethylphenoxy)-1-methyl-piperidin-1-ium chloride Openeye Name: 3-(2,6-dimethylphenoxy)-1-methyl-piperidin-1-ium chloride CAS Name: 3-(2,6-dimethylphenoxy)-1-methylpiperidin-1-ium chloride IUPAC Name: 3-(2,6-dimethylphenoxy)-1-methylpiperidin-1-ium chloride Traditional Name: 3-(2,6-dimethylphenoxy)-1-methyl-piperidin-1-ium chloride Formula: C14H22ClNO MolecularWeight: 255.78358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC2CCC[NH+](C2)C.[Cl-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC2CCC[NH+](C2)C.[Cl-]

InChI

InChI=1S/C14H21NO.ClH/c1-11-6-4-7-12(2)14(11)16-13-8-5-9-15(3)10-13;/h4,6-7,13H,5,8-10H2,1-3H3;1H