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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC=NC=C2)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC=NC=C2)C3=CC4=CC=CC=C4C=C3

InChI

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