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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CN=CC=C2)C3=CC=CC4=CC=CC=C43)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=CN=CC=C2)C3=CC=CC4=CC=CC=C43)C(=O)O

InChI

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