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

Systemtic Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(2-ethyl-3-methyl-quinolin-4-yl)ethanamide Openeye Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(2-ethyl-3-methyl-4-quinolyl)acetamide CAS Name: 2-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-N-(2-ethyl-3-methyl-4-quinolinyl)acetamide IUPAC Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(2-ethyl-3-methylquinolin-4-yl)acetamide Traditional Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(2-ethyl-3-methyl-4-quinolyl)acetamide Formula: C21H30N3O+ MolecularWeight: 340.4824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)NC(=O)C[NH+]3CC(CC(C3)C)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)NC(=O)C[NH+]3C[C@@H](C[C@H](C3)C)C

InChI

InChI=1S/C21H29N3O/c1-5-18-16(4)21(17-8-6-7-9-19(17)22-18)23-20(25)13-24-11-14(2)10-15(3)12-24/h6-9,14-15H,5,10-13H2,1-4H3,(H,22,23,25)/p+1/t14-,15-/m1/s1