1-[1-(5-ethylpyridin-2-yl)-2-pyridin-2-yl-ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1-(5-ethylpyridin-2-yl)-2-pyridin-2-yl-ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(5-ethyl-2-pyridyl)-2-(2-pyridyl)ethyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(5-ethyl-2-pyridinyl)-2-(2-pyridinyl)ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-(5-ethylpyridin-2-yl)-2-pyridin-2-ylethyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(5-ethyl-2-pyridyl)-2-(2-pyridyl)ethyl]isonipecotic acid Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C(CC2=CC=CC=N2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CCC1=CN=C(C=C1)C(CC2=CC=CC=N2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C20H25N3O2/c1-2-15-6-7-18(22-14-15)19(13-17-5-3-4-10-21-17)23-11-8-16(9-12-23)20(24)25/h3-7,10,14,16,19H,2,8-9,11-13H2,1H3,(H,24,25)