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

Systemtic Name: 7-azanylidene-8-ethyl-3-phenethyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Openeye Name: 8-ethyl-7-imino-3-phenethyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile CAS Name: 8-ethyl-7-imino-3-phenethyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile IUPAC Name: 8-ethyl-7-imino-3-phenethyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Traditional Name: 8-ethyl-7-imino-3-phenethyl-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Formula: C25H22N4O2 MolecularWeight: 410.46778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C2(C(=N)OC1(OC(C2(C#N)C#N)CCC3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CCC1C2(C(=N)OC1(OC(C2(C#N)C#N)CCC3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

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