6-azanylidene-8-ethyl-3-(3-phenoxyphenyl)-1-propyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile

Systemtic Name: 6-azanylidene-8-ethyl-3-(3-phenoxyphenyl)-1-propyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 8-ethyl-6-imino-3-(3-phenoxyphenyl)-1-propyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 8-ethyl-6-imino-3-(3-phenoxyphenyl)-1-propyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 8-ethyl-6-imino-3-(3-phenoxyphenyl)-1-propyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 8-ethyl-6-imino-3-(3-phenoxyphenyl)-1-propyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C26H24N4O3 MolecularWeight: 440.49376

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Descriptors Computed from Structure

Canonical SMILES:

CCCC12C(C(C(=N)O1)(C(C(O2)C3=CC(=CC=C3)OC4=CC=CC=C4)(C#N)C#N)C#N)CC

Isomeric SMILES

CCCC12C(C(C(=N)O1)(C(C(O2)C3=CC(=CC=C3)OC4=CC=CC=C4)(C#N)C#N)C#N)CC

InChI

InChI=1S/C26H24N4O3/c1-3-13-26-21(4-2)25(17-29,23(30)33-26)24(15-27,16-28)22(32-26)18-9-8-12-20(14-18)31-19-10-6-5-7-11-19/h5-12,14,21-22,30H,3-4,13H2,1-2H3