(2S)-2-methyl-3-(4-methylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-one

Systemtic Name: (2S)-2-methyl-3-(4-methylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-one Openeye Name: (2S)-2-methyl-3-(4-methylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-one CAS Name: (2S)-2-methyl-3-(4-methyl-1-piperidin-1-iumyl)-1-phenyl-1-propanone IUPAC Name: (2S)-2-methyl-3-(4-methylpiperidin-1-ium-1-yl)-1-phenylpropan-1-one Traditional Name: (2S)-2-methyl-3-(4-methylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-one Formula: C16H24NO+ MolecularWeight: 246.36786

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(C)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC1CC[NH+](CC1)C[C@H](C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H23NO/c1-13-8-10-17(11-9-13)12-14(2)16(18)15-6-4-3-5-7-15/h3-7,13-14H,8-12H2,1-2H3/p+1/t14-/m0/s1