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

Systemtic Name: 2-methyl-1-(4-methylphenyl)-3-piperidin-1-ium-1-yl-propan-1-one Openeye Name: 2-methyl-3-piperidin-1-ium-1-yl-1-(p-tolyl)propan-1-one CAS Name: 2-methyl-1-(4-methylphenyl)-3-(1-piperidin-1-iumyl)-1-propanone IUPAC Name: 2-methyl-1-(4-methylphenyl)-3-piperidin-1-ium-1-ylpropan-1-one Traditional Name: 2-methyl-3-piperidin-1-ium-1-yl-1-(p-tolyl)propan-1-one Formula: C16H24NO+ MolecularWeight: 246.36786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO/c1-13-6-8-15(9-7-13)16(18)14(2)12-17-10-4-3-5-11-17/h6-9,14H,3-5,10-12H2,1-2H3/p+1