2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)ethanamide Openeye Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)acetamide CAS Name: 2-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-N-(3-methylsulfonylphenyl)acetamide IUPAC Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)acetamide Traditional Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(3-mesylphenyl)acetamide Formula: C16H25N2O3S+ MolecularWeight: 325.4463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O3S/c1-12-7-13(2)10-18(9-12)11-16(19)17-14-5-4-6-15(8-14)22(3,20)21/h4-6,8,12-13H,7,9-11H2,1-3H3,(H,17,19)/p+1/t12-,13-/m1/s1