(2S)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-naphthalen-2-yl-propanamide

Systemtic Name: (2S)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-naphthalen-2-yl-propanamide Openeye Name: (2S)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(2-naphthyl)propanamide CAS Name: (2S)-2-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-N-(2-naphthalenyl)propanamide IUPAC Name: (2S)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-naphthalen-2-ylpropanamide Traditional Name: (2S)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(2-naphthyl)propionamide Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)C(C)C(=O)NC2=CC3=CC=CC=C3C=C2)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)[C@@H](C)C(=O)NC2=CC3=CC=CC=C3C=C2)C

InChI

InChI=1S/C20H26N2O/c1-14-10-15(2)13-22(12-14)16(3)20(23)21-19-9-8-17-6-4-5-7-18(17)11-19/h4-9,11,14-16H,10,12-13H2,1-3H3,(H,21,23)/p+1/t14-,15-,16+/m1/s1