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

Systemtic Name: 6-azanylidene-1-ethyl-8-methyl-3-(4-phenylmethoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 3-(4-benzyloxyphenyl)-1-ethyl-6-imino-8-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 1-ethyl-6-imino-8-methyl-3-(4-phenylmethoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 1-ethyl-6-imino-8-methyl-3-(4-phenylmethoxyphenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 3-(4-benzoxyphenyl)-1-ethyl-6-imino-8-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C25H22N4O3 MolecularWeight: 426.46718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC12C(C(C(=N)O1)(C(C(O2)C3=CC=C(C=C3)OCC4=CC=CC=C4)(C#N)C#N)C#N)C

Isomeric SMILES

CCC12C(C(C(=N)O1)(C(C(O2)C3=CC=C(C=C3)OCC4=CC=CC=C4)(C#N)C#N)C#N)C

InChI

InChI=1S/C25H22N4O3/c1-3-25-17(2)24(16-28,22(29)32-25)23(14-26,15-27)21(31-25)19-9-11-20(12-10-19)30-13-18-7-5-4-6-8-18/h4-12,17,21,29H,3,13H2,1-2H3