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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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