2-(3-chloranyl-4-fluoranyl-phenoxy)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: 2-(3-chloranyl-4-fluoranyl-phenoxy)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-(3-chloro-4-fluoro-phenoxy)-N-(1-isopropylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-(3-chloro-4-fluorophenoxy)-N-(1-propan-2-yl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-(3-chloro-4-fluorophenoxy)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-(3-chloro-4-fluoro-phenoxy)-N-(1-isopropylpiperidin-1-ium-4-yl)acetamide Formula: C16H23ClFN2O2+ MolecularWeight: 329.817423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC(=O)COC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC(=O)COC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C16H22ClFN2O2/c1-11(2)20-7-5-12(6-8-20)19-16(21)10-22-13-3-4-15(18)14(17)9-13/h3-4,9,11-12H,5-8,10H2,1-2H3,(H,19,21)/p+1