7-azanylidene-8-methyl-5-(4-methylphenyl)-3-phenethyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile

Systemtic Name: 7-azanylidene-8-methyl-5-(4-methylphenyl)-3-phenethyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Openeye Name: 7-imino-8-methyl-3-phenethyl-5-(p-tolyl)-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile CAS Name: 7-imino-8-methyl-5-(4-methylphenyl)-3-phenethyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile IUPAC Name: 7-imino-8-methyl-5-(4-methylphenyl)-3-phenethyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Traditional Name: 7-imino-8-methyl-3-phenethyl-5-(p-tolyl)-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2(C(=N)OC1(OC(C2(C#N)C#N)CCC3=CC=CC=C3)C4=CC=C(C=C4)C)C#N

Isomeric SMILES

CC1C2(C(=N)OC1(OC(C2(C#N)C#N)CCC3=CC=CC=C3)C4=CC=C(C=C4)C)C#N

InChI

InChI=1S/C25H22N4O2/c1-17-8-11-20(12-9-17)25-18(2)24(16-28,22(29)31-25)23(14-26,15-27)21(30-25)13-10-19-6-4-3-5-7-19/h3-9,11-12,18,21,29H,10,13H2,1-2H3