3-[(1R,3R)-3-(2-cyanoethyl)-2-oxidanylidene-cyclohexyl]propanenitrile

Systemtic Name: 3-[(1R,3R)-3-(2-cyanoethyl)-2-oxidanylidene-cyclohexyl]propanenitrile Openeye Name: 3-[(1R,3R)-3-(2-cyanoethyl)-2-oxo-cyclohexyl]propanenitrile CAS Name: 3-[(1R,3R)-3-(2-cyanoethyl)-2-oxocyclohexyl]propanenitrile IUPAC Name: 3-[(1R,3R)-3-(2-cyanoethyl)-2-oxocyclohexyl]propanenitrile Traditional Name: 3-[(1R,3R)-3-(2-cyanoethyl)-2-keto-cyclohexyl]propionitrile Formula: C12H16N2O MolecularWeight: 204.26824

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)C(C1)CCC#N)CCC#N

Isomeric SMILES

C1C[C@@H](C(=O)[C@H](C1)CCC#N)CCC#N

InChI

InChI=1S/C12H16N2O/c13-8-2-6-10-4-1-5-11(12(10)15)7-3-9-14/h10-11H,1-7H2/t10-,11-/m1/s1