N-(2-cyanoethyl)-N-(2-fluorophenyl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperidin-1-ium-1-yl)-N-(2-cyanoethyl)-N-(2-fluorophenyl)acetamide CAS Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]acetamide IUPAC Name: 2-(4-benzylpiperidin-1-ium-1-yl)-N-(2-cyanoethyl)-N-(2-fluorophenyl)acetamide Traditional Name: 2-(4-benzylpiperidin-1-ium-1-yl)-N-(2-cyanoethyl)-N-(2-fluorophenyl)acetamide Formula: C23H27FN3O+ MolecularWeight: 380.478383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC(=O)N(CCC#N)C3=CC=CC=C3F

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC(=O)N(CCC#N)C3=CC=CC=C3F

InChI

InChI=1S/C23H26FN3O/c24-21-9-4-5-10-22(21)27(14-6-13-25)23(28)18-26-15-11-20(12-16-26)17-19-7-2-1-3-8-19/h1-5,7-10,20H,6,11-12,14-18H2/p+1