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

Systemtic Name: 6-azanylidene-1-ethyl-3-(4-heptoxyphenyl)-8-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 1-ethyl-3-(4-heptoxyphenyl)-6-imino-8-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 1-ethyl-3-(4-heptoxyphenyl)-6-imino-8-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 1-ethyl-3-(4-heptoxyphenyl)-6-imino-8-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 1-ethyl-3-(4-heptoxyphenyl)-6-imino-8-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C25H30N4O3 MolecularWeight: 434.5307

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2C(C3(C(C(O2)(OC3=N)CC)C)C#N)(C#N)C#N

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2C(C3(C(C(O2)(OC3=N)CC)C)C#N)(C#N)C#N

InChI

InChI=1S/C25H30N4O3/c1-4-6-7-8-9-14-30-20-12-10-19(11-13-20)21-23(15-26,16-27)24(17-28)18(3)25(5-2,31-21)32-22(24)29/h10-13,18,21,29H,4-9,14H2,1-3H3