3-[3-(2-cyanoethyl)-6-methyl-4-oxidanylidene-oxan-3-yl]propanenitrile

Systemtic Name: 3-[3-(2-cyanoethyl)-6-methyl-4-oxidanylidene-oxan-3-yl]propanenitrile Openeye Name: 3-[3-(2-cyanoethyl)-6-methyl-4-oxo-tetrahydropyran-3-yl]propanenitrile CAS Name: 3-[3-(2-cyanoethyl)-6-methyl-4-oxo-3-oxanyl]propanenitrile IUPAC Name: 3-[3-(2-cyanoethyl)-6-methyl-4-oxooxan-3-yl]propanenitrile Traditional Name: 3-[3-(2-cyanoethyl)-4-keto-6-methyl-tetrahydropyran-3-yl]propionitrile Formula: C12H16N2O2 MolecularWeight: 220.26764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(CO1)(CCC#N)CCC#N

Isomeric SMILES

CC1CC(=O)C(CO1)(CCC#N)CCC#N

InChI

InChI=1S/C12H16N2O2/c1-10-8-11(15)12(9-16-10,4-2-6-13)5-3-7-14/h10H,2-5,8-9H2,1H3