1-(4-methylphenyl)-3-piperidin-1-ium-1-yl-propan-1-one chloride

Systemtic Name: 1-(4-methylphenyl)-3-piperidin-1-ium-1-yl-propan-1-one chloride Openeye Name: 3-piperidin-1-ium-1-yl-1-(p-tolyl)propan-1-one chloride CAS Name: 1-(4-methylphenyl)-3-(1-piperidin-1-iumyl)-1-propanone chloride IUPAC Name: 1-(4-methylphenyl)-3-piperidin-1-ium-1-ylpropan-1-one chloride Traditional Name: 3-piperidin-1-ium-1-yl-1-(p-tolyl)propan-1-one chloride Formula: C15H22ClNO MolecularWeight: 267.79428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CC[NH+]2CCCCC2.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CC[NH+]2CCCCC2.[Cl-]

InChI

InChI=1S/C15H21NO.ClH/c1-13-5-7-14(8-6-13)15(17)9-12-16-10-3-2-4-11-16;/h5-8H,2-4,9-12H2,1H3;1H