1-(5-cyanopyridin-1-ium-2-yl)-N-(diphenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(5-cyanopyridin-1-ium-2-yl)-N-(diphenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzhydryl-1-(5-cyanopyridin-1-ium-2-yl)piperidine-4-carboxamide CAS Name: 1-(5-cyano-2-pyridin-1-iumyl)-N-(diphenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzhydryl-1-(5-cyanopyridin-1-ium-2-yl)piperidine-4-carboxamide Traditional Name: N-benzhydryl-1-(5-cyanopyridin-1-ium-2-yl)isonipecotamide Formula: C25H25N4O+ MolecularWeight: 397.4922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)C4=[NH+]C=C(C=C4)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)C4=[NH+]C=C(C=C4)C#N

InChI

InChI=1S/C25H24N4O/c26-17-19-11-12-23(27-18-19)29-15-13-22(14-16-29)25(30)28-24(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,18,22,24H,13-16H2,(H,28,30)/p+1