(2S)-2-[(2,6-dimethylphenoxy)methyl]-1-methyl-pyrrolidin-1-ium chloride

Systemtic Name: (2S)-2-[(2,6-dimethylphenoxy)methyl]-1-methyl-pyrrolidin-1-ium chloride Openeye Name: (2S)-2-[(2,6-dimethylphenoxy)methyl]-1-methyl-pyrrolidin-1-ium chloride CAS Name: (2S)-2-[(2,6-dimethylphenoxy)methyl]-1-methylpyrrolidin-1-ium chloride IUPAC Name: (2S)-2-[(2,6-dimethylphenoxy)methyl]-1-methylpyrrolidin-1-ium chloride Traditional Name: (2S)-2-[(2,6-dimethylphenoxy)methyl]-1-methyl-pyrrolidin-1-ium chloride Formula: C14H22ClNO MolecularWeight: 255.78358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC2CCC[NH+]2C.[Cl-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC[C@@H]2CCC[NH+]2C.[Cl-]

InChI

InChI=1S/C14H21NO.ClH/c1-11-6-4-7-12(2)14(11)16-10-13-8-5-9-15(13)3;/h4,6-7,13H,5,8-10H2,1-3H3;1H/t13-;/m0./s1