methyl (2R)-2-(4-methylphenyl)-2-[(2S)-piperidin-1-ium-2-yl]ethanoate chloride

Systemtic Name: methyl (2R)-2-(4-methylphenyl)-2-[(2S)-piperidin-1-ium-2-yl]ethanoate chloride Openeye Name: methyl (2R)-2-[(2S)-piperidin-1-ium-2-yl]-2-(p-tolyl)acetate chloride CAS Name: (2R)-2-(4-methylphenyl)-2-[(2S)-2-piperidin-1-iumyl]acetic acid methyl ester chloride IUPAC Name: methyl (2R)-2-(4-methylphenyl)-2-[(2S)-piperidin-1-ium-2-yl]acetate chloride Traditional Name: (2R)-2-[(2S)-piperidin-1-ium-2-yl]-2-(p-tolyl)acetic acid methyl ester chloride Formula: C15H22ClNO2 MolecularWeight: 283.79368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2CCCC[NH2+]2)C(=O)OC.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]([C@@H]2CCCC[NH2+]2)C(=O)OC.[Cl-]

InChI

InChI=1S/C15H21NO2.ClH/c1-11-6-8-12(9-7-11)14(15(17)18-2)13-5-3-4-10-16-13;/h6-9,13-14,16H,3-5,10H2,1-2H3;1H/t13-,14+;/m0./s1