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

Systemtic Name: 1-[pyridin-3-yl(quinolin-3-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[3-pyridyl(3-quinolyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[3-pyridinyl(3-quinolinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[pyridin-3-yl(quinolin-3-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-pyridyl(3-quinolyl)methyl]isonipecotic acid Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CN=CC=C2)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CN=CC=C2)C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C21H21N3O2/c25-21(26)15-7-10-24(11-8-15)20(17-5-3-9-22-13-17)18-12-16-4-1-2-6-19(16)23-14-18/h1-6,9,12-15,20H,7-8,10-11H2,(H,25,26)