4-[5-(1,3-dihydroisoindol-2-yl)-1-methyl-6-oxidanylidene-4-pyridin-4-yl-pyridin-2-yl]piperidine-1-carboxylic acid

Systemtic Name: 4-[5-(1,3-dihydroisoindol-2-yl)-1-methyl-6-oxidanylidene-4-pyridin-4-yl-pyridin-2-yl]piperidine-1-carboxylic acid Openeye Name: 4-[5-isoindolin-2-yl-1-methyl-6-oxo-4-(4-pyridyl)-2-pyridyl]piperidine-1-carboxylic acid CAS Name: 4-[5-(1,3-dihydroisoindol-2-yl)-1-methyl-6-oxo-4-pyridin-4-yl-2-pyridinyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[5-(1,3-dihydroisoindol-2-yl)-1-methyl-6-oxo-4-pyridin-4-ylpyridin-2-yl]piperidine-1-carboxylic acid Traditional Name: 4-[5-isoindolin-2-yl-6-keto-1-methyl-4-(4-pyridyl)-2-pyridyl]piperidine-1-carboxylic acid Formula: C25H26N4O3 MolecularWeight: 430.49894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=C(C1=O)N2CC3=CC=CC=C3C2)C4=CC=NC=C4)C5CCN(CC5)C(=O)O

Isomeric SMILES

CN1C(=CC(=C(C1=O)N2CC3=CC=CC=C3C2)C4=CC=NC=C4)C5CCN(CC5)C(=O)O

InChI

InChI=1S/C25H26N4O3/c1-27-22(18-8-12-28(13-9-18)25(31)32)14-21(17-6-10-26-11-7-17)23(24(27)30)29-15-19-4-2-3-5-20(19)16-29/h2-7,10-11,14,18H,8-9,12-13,15-16H2,1H3,(H,31,32)