2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[2-(phenylcarbonyl)phenyl]ethanamide

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-[2-(phenylcarbonyl)phenyl]ethanamide Openeye Name: N-(2-benzoylphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(2-benzoylphenyl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(2-benzoylphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(2-benzoylphenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C21H25N2O2+ MolecularWeight: 337.4354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2/c1-16-8-7-13-23(14-16)15-20(24)22-19-12-6-5-11-18(19)21(25)17-9-3-2-4-10-17/h2-6,9-12,16H,7-8,13-15H2,1H3,(H,22,24)/p+1/t16-/m0/s1