7-azanylidene-8-methyl-3-pentyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile

Systemtic Name: 7-azanylidene-8-methyl-3-pentyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Openeye Name: 7-imino-8-methyl-3-pentyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile CAS Name: 7-imino-8-methyl-3-pentyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile IUPAC Name: 7-imino-8-methyl-3-pentyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Traditional Name: 3-amyl-7-imino-8-methyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(C2(C(C(O1)(OC2=N)C3=CC=CC=C3)C)C#N)(C#N)C#N

Isomeric SMILES

CCCCCC1C(C2(C(C(O1)(OC2=N)C3=CC=CC=C3)C)C#N)(C#N)C#N

InChI

InChI=1S/C21H22N4O2/c1-3-4-6-11-17-19(12-22,13-23)20(14-24)15(2)21(26-17,27-18(20)25)16-9-7-5-8-10-16/h5,7-10,15,17,25H,3-4,6,11H2,1-2H3