1-[naphthalen-2-yl(pyridin-3-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[naphthalen-2-yl(pyridin-3-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-naphthyl(3-pyridyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[2-naphthalenyl(3-pyridinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[naphthalen-2-yl(pyridin-3-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-naphthyl(3-pyridyl)methyl]isonipecotic acid Formula: C22H22N2O2 MolecularWeight: 346.42228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC3=CC=CC=C3C=C2)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC3=CC=CC=C3C=C2)C4=CN=CC=C4

InChI

InChI=1S/C22H22N2O2/c25-22(26)17-9-12-24(13-10-17)21(20-6-3-11-23-15-20)19-8-7-16-4-1-2-5-18(16)14-19/h1-8,11,14-15,17,21H,9-10,12-13H2,(H,25,26)