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

Systemtic Name: 3-azanylidene-1,5-dimethyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile Openeye Name: 3-imino-1,5-dimethyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile CAS Name: 3-imino-1,5-dimethyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile IUPAC Name: 3-imino-1,5-dimethyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile Traditional Name: 3-imino-1,5-dimethyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile Formula: C17H14N4O2 MolecularWeight: 306.31866

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2(C(=N)OC(O1)(C(C2(C#N)C#N)C3=CC=CC=C3)C)C#N

Isomeric SMILES

CC1C2(C(=N)OC(O1)(C(C2(C#N)C#N)C3=CC=CC=C3)C)C#N

InChI

InChI=1S/C17H14N4O2/c1-11-17(10-20)14(21)23-15(2,22-11)13(16(17,8-18)9-19)12-6-4-3-5-7-12/h3-7,11,13,21H,1-2H3