N-[(3R)-1-cycloheptylpiperidin-1-ium-3-yl]-2-(5-ethanoylthiophen-3-yl)ethanamide

Systemtic Name: N-[(3R)-1-cycloheptylpiperidin-1-ium-3-yl]-2-(5-ethanoylthiophen-3-yl)ethanamide Openeye Name: 2-(5-acetyl-3-thienyl)-N-[(3R)-1-cycloheptylpiperidin-1-ium-3-yl]acetamide CAS Name: 2-(5-acetyl-3-thiophenyl)-N-[(3R)-1-cycloheptyl-3-piperidin-1-iumyl]acetamide IUPAC Name: 2-(5-acetylthiophen-3-yl)-N-[(3R)-1-cycloheptylpiperidin-1-ium-3-yl]acetamide Traditional Name: 2-(5-acetyl-3-thienyl)-N-[(3R)-1-cycloheptylpiperidin-1-ium-3-yl]acetamide Formula: C20H31N2O2S+ MolecularWeight: 363.53734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CS1)CC(=O)NC2CCC[NH+](C2)C3CCCCCC3

Isomeric SMILES

CC(=O)C1=CC(=CS1)CC(=O)N[C@@H]2CCC[NH+](C2)C3CCCCCC3

InChI

InChI=1S/C20H30N2O2S/c1-15(23)19-11-16(14-25-19)12-20(24)21-17-7-6-10-22(13-17)18-8-4-2-3-5-9-18/h11,14,17-18H,2-10,12-13H2,1H3,(H,21,24)/p+1/t17-/m1/s1