3-azanylidene-5-ethyl-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile

Systemtic Name: 3-azanylidene-5-ethyl-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile Openeye Name: 5-ethyl-3-imino-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile CAS Name: 5-ethyl-3-imino-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile IUPAC Name: 5-ethyl-3-imino-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile Traditional Name: 5-ethyl-3-imino-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile Formula: C13H14N4O2 MolecularWeight: 258.27586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C2(C(=N)OC(O1)(C(C2(C#N)C#N)C)C)C#N

Isomeric SMILES

CCC1C2(C(=N)OC(O1)(C(C2(C#N)C#N)C)C)C#N

InChI

InChI=1S/C13H14N4O2/c1-4-9-13(7-16)10(17)19-11(3,18-9)8(2)12(13,5-14)6-15/h8-9,17H,4H2,1-3H3