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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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