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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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