1-(phenylmethyl)-4-pyridin-4-yl-piperidine-4-carboxylic acid

Systemtic Name: 1-(phenylmethyl)-4-pyridin-4-yl-piperidine-4-carboxylic acid Openeye Name: 1-benzyl-4-(4-pyridyl)piperidine-4-carboxylic acid CAS Name: 1-(phenylmethyl)-4-pyridin-4-yl-4-piperidinecarboxylic acid IUPAC Name: 1-benzyl-4-pyridin-4-ylpiperidine-4-carboxylic acid Traditional Name: 1-benzyl-4-(4-pyridyl)isonipecotic acid Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=NC=C2)C(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1(C2=CC=NC=C2)C(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2/c21-17(22)18(16-6-10-19-11-7-16)8-12-20(13-9-18)14-15-4-2-1-3-5-15/h1-7,10-11H,8-9,12-14H2,(H,21,22)