1-(1-isoquinolin-6-yl-2-pyridin-2-yl-ethyl)piperidine-4-carboxylic acid

Systemtic Name: 1-(1-isoquinolin-6-yl-2-pyridin-2-yl-ethyl)piperidine-4-carboxylic acid Openeye Name: 1-[1-(6-isoquinolyl)-2-(2-pyridyl)ethyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(6-isoquinolinyl)-2-(2-pyridinyl)ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(1-isoquinolin-6-yl-2-pyridin-2-ylethyl)piperidine-4-carboxylic acid Traditional Name: 1-[1-(6-isoquinolyl)-2-(2-pyridyl)ethyl]isonipecotic acid Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(CC2=CC=CC=N2)C3=CC4=C(C=C3)C=NC=C4

Isomeric SMILES

C1CN(CCC1C(=O)O)C(CC2=CC=CC=N2)C3=CC4=C(C=C3)C=NC=C4

InChI

InChI=1S/C22H23N3O2/c26-22(27)16-7-11-25(12-8-16)21(14-20-3-1-2-9-24-20)18-4-5-19-15-23-10-6-17(19)13-18/h1-6,9-10,13,15-16,21H,7-8,11-12,14H2,(H,26,27)