4-(2-cyanoethyl)-4-(6-methylpyridin-3-yl)carbonyl-heptanedinitrile

Systemtic Name: 4-(2-cyanoethyl)-4-(6-methylpyridin-3-yl)carbonyl-heptanedinitrile Openeye Name: 4-(2-cyanoethyl)-4-(6-methylpyridine-3-carbonyl)heptanedinitrile CAS Name: 4-(2-cyanoethyl)-4-[(6-methyl-3-pyridinyl)-oxomethyl]heptanedinitrile IUPAC Name: 4-(2-cyanoethyl)-4-(6-methylpyridine-3-carbonyl)heptanedinitrile Traditional Name: 4-(2-cyanoethyl)-4-(6-methylnicotinoyl)pimelonitrile Formula: C17H18N4O MolecularWeight: 294.35102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)C(CCC#N)(CCC#N)CCC#N

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)C(CCC#N)(CCC#N)CCC#N

InChI

InChI=1S/C17H18N4O/c1-14-5-6-15(13-21-14)16(22)17(7-2-10-18,8-3-11-19)9-4-12-20/h5-6,13H,2-4,7-9H2,1H3