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

Systemtic Name: 3-[1,3,3-tris(2-cyanoethyl)-2-oxidanylidene-cyclohexyl]propanenitrile Openeye Name: 3-[1,3,3-tris(2-cyanoethyl)-2-oxo-cyclohexyl]propanenitrile CAS Name: 3-[1,3,3-tris(2-cyanoethyl)-2-oxocyclohexyl]propanenitrile IUPAC Name: 3-[1,3,3-tris(2-cyanoethyl)-2-oxocyclohexyl]propanenitrile Traditional Name: 3-[1,3,3-tris(2-cyanoethyl)-2-keto-cyclohexyl]propionitrile Formula: C18H22N4O MolecularWeight: 310.39348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O/c19-12-2-8-17(9-3-13-20)6-1-7-18(16(17)23,10-4-14-21)11-5-15-22/h1-11H2