N-(2-cyanoethyl)-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-cyanoethyl)-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: N-(2-cyanoethyl)-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: N-(2-cyanoethyl)-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: N-(2-cyanoethyl)-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: N-(2-cyanoethyl)-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C15H20N3O+ MolecularWeight: 258.3388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C(=O)N(CCC#N)C2=CC=CC=C2

Isomeric SMILES

C1C[NH2+]CCC1C(=O)N(CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C15H19N3O/c16-9-4-12-18(14-5-2-1-3-6-14)15(19)13-7-10-17-11-8-13/h1-3,5-6,13,17H,4,7-8,10-12H2/p+1