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

Systemtic Name: 6-azanylidene-8-ethyl-3-(4-hexoxyphenyl)-1-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 8-ethyl-3-(4-hexoxyphenyl)-6-imino-1-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 8-ethyl-3-(4-hexoxyphenyl)-6-imino-1-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 8-ethyl-3-(4-hexoxyphenyl)-6-imino-1-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 8-ethyl-3-(4-hexoxyphenyl)-6-imino-1-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2C(C3(C(C(O2)(OC3=N)C)CC)C#N)(C#N)C#N

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2C(C3(C(C(O2)(OC3=N)C)CC)C#N)(C#N)C#N

InChI

InChI=1S/C24H28N4O3/c1-4-6-7-8-13-29-18-11-9-17(10-12-18)20-23(14-25,15-26)24(16-27)19(5-2)22(3,30-20)31-21(24)28/h9-12,19-20,28H,4-8,13H2,1-3H3