3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-phenyl-propanamide

Systemtic Name: 3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-phenyl-propanamide Openeye Name: 3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-phenyl-propanamide CAS Name: 3-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-N-phenylpropanamide IUPAC Name: 3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-phenylpropanamide Traditional Name: 3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-phenyl-propionamide Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O/c1-13-10-14(2)12-18(11-13)9-8-16(19)17-15-6-4-3-5-7-15/h3-7,13-14H,8-12H2,1-2H3,(H,17,19)/p+1/t13-,14-/m1/s1