1-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylic acid

Systemtic Name: 1-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylic acid Openeye Name: 1-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylic acid CAS Name: 1-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]-4-piperidinecarboxylic acid IUPAC Name: 1-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]piperidine-4-carboxylic acid Traditional Name: 1-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]isonipecotic acid Formula: C21H18N4O2 MolecularWeight: 358.39322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=NC(=C3C(=C2)C=CC=N3)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=NC(=C3C(=C2)C=CC=N3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H18N4O2/c22-13-14-3-1-4-16(11-14)20-19-17(5-2-8-23-19)12-18(24-20)25-9-6-15(7-10-25)21(26)27/h1-5,8,11-12,15H,6-7,9-10H2,(H,26,27)