2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)-N-(6-piperidin-1-ylpyridin-3-yl)ethanamide

Systemtic Name: 2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)-N-(6-piperidin-1-ylpyridin-3-yl)ethanamide Openeye Name: 2-(1-methylene-3-oxo-isoindolin-2-yl)-N-[6-(1-piperidyl)-3-pyridyl]acetamide CAS Name: 2-(1-methylene-3-oxo-2-isoindolyl)-N-[6-(1-piperidinyl)-3-pyridinyl]acetamide IUPAC Name: 2-(1-methylidene-3-oxoisoindol-2-yl)-N-(6-piperidin-1-ylpyridin-3-yl)acetamide Traditional Name: 2-(1-keto-3-methylene-isoindolin-2-yl)-N-(6-piperidino-3-pyridyl)acetamide Formula: C21H22N4O2 MolecularWeight: 362.42498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CC(=O)NC3=CN=C(C=C3)N4CCCCC4

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CC(=O)NC3=CN=C(C=C3)N4CCCCC4

InChI

InChI=1S/C21H22N4O2/c1-15-17-7-3-4-8-18(17)21(27)25(15)14-20(26)23-16-9-10-19(22-13-16)24-11-5-2-6-12-24/h3-4,7-10,13H,1-2,5-6,11-12,14H2,(H,23,26)