2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-ethylphenyl)ethanamide

Systemtic Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-ethylphenyl)ethanamide Openeye Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-ethylphenyl)acetamide CAS Name: 2-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-N-(4-ethylphenyl)acetamide IUPAC Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-ethylphenyl)acetamide Traditional Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(4-ethylphenyl)acetamide Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C[NH+]2CC(CC(C2)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C[NH+]2C[C@@H](C[C@H](C2)C)C

InChI

InChI=1S/C17H26N2O/c1-4-15-5-7-16(8-6-15)18-17(20)12-19-10-13(2)9-14(3)11-19/h5-8,13-14H,4,9-12H2,1-3H3,(H,18,20)/p+1/t13-,14-/m1/s1