4-(2-cyanoethyl)-4-pyridin-2-ylcarbonyl-heptanedinitrile

Systemtic Name: 4-(2-cyanoethyl)-4-pyridin-2-ylcarbonyl-heptanedinitrile Openeye Name: 4-(2-cyanoethyl)-4-(pyridine-2-carbonyl)heptanedinitrile CAS Name: 4-(2-cyanoethyl)-4-[oxo(2-pyridinyl)methyl]heptanedinitrile IUPAC Name: 4-(2-cyanoethyl)-4-(pyridine-2-carbonyl)heptanedinitrile Traditional Name: 4-(2-cyanoethyl)-4-picolinoyl-pimelonitrile Formula: C16H16N4O MolecularWeight: 280.32444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=O)C(CCC#N)(CCC#N)CCC#N

Isomeric SMILES

C1=CC=NC(=C1)C(=O)C(CCC#N)(CCC#N)CCC#N

InChI

InChI=1S/C16H16N4O/c17-10-3-7-16(8-4-11-18,9-5-12-19)15(21)14-6-1-2-13-20-14/h1-2,6,13H,3-5,7-9H2