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

Systemtic Name: 3-azanylidene-5-butyl-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile Openeye Name: 5-butyl-3-imino-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile CAS Name: 5-butyl-3-imino-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile IUPAC Name: 5-butyl-3-imino-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile Traditional Name: 5-butyl-3-imino-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile Formula: C15H18N4O2 MolecularWeight: 286.32902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C2(C(=N)OC(O1)(C(C2(C#N)C#N)C)C)C#N

Isomeric SMILES

CCCCC1C2(C(=N)OC(O1)(C(C2(C#N)C#N)C)C)C#N

InChI

InChI=1S/C15H18N4O2/c1-4-5-6-11-15(9-18)12(19)21-13(3,20-11)10(2)14(15,7-16)8-17/h10-11,19H,4-6H2,1-3H3